ChemLookup

http://ChemLookup.com Compounds

2012-02-28T18:35:00.001-08:00

CAS RN: 111510-20-4
CAS Name: (2S,3S,4S,5R,6S)-6-[[(2R,4aS,6aS,6bR,10S,12aS,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picen-2-yl]-oxomethoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6S)-6-[(2R,4aS,6aS,6bR,10S,12aS,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carbonyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6S)-6-[(2R,4aS,6aS,6bR,10S,12aS,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6S)-6-[[(2R,4aS,6aS,6bR,10S,12aS,14bS)-2,4a,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-13-oxidanylidene-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picen-2-yl]carbonyloxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C36H54O10
MOLECULAR WEIGHT: 646.80796
SMILES: C[C@]12CC[C@@](C[C@@H]1C3=CC(=O)C4[C@]5(CC[C@@H](C(C5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)(C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O
Structure:

CAS RN: 111506-16-2
CAS Name: 2-amino-5-(aminomethyl)-4-thiazolone dihydrobromide
OPENEYE Name: 2-amino-5-(aminomethyl)thiazol-4-one dihydrobromide
IUPAC Name: 2-amino-5-(aminomethyl)-1,3-thiazol-4-one dihydrobromide
SYSTEMATIC NAME: 5-(aminomethyl)-2-azanyl-1,3-thiazol-4-one dihydrobromide
MOLECULAR FORMULA: C4H9Br2N3OS
MOLECULAR WEIGHT: 307.00676
SMILES: C(C1C(=O)N=C(S1)N)N.Br.Br
Structure:

CAS RN: 1115-94-2
CAS Name: 2,6,10-trimethylundecanoic acid
OPENEYE Name: 2,6,10-trimethylundecanoic acid
IUPAC Name: 2,6,10-trimethylundecanoic acid
SYSTEMATIC NAME: 2,6,10-trimethylundecanoic acid
MOLECULAR FORMULA: C14H28O2
MOLECULAR WEIGHT: 228.37092
SMILES: CC(C)CCCC(C)CCCC(C)C(=O)O
Structure:

CAS RN: 111588-20-6
CAS Name: 1-methyl-1-[2-[2-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]ethoxy]ethyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethoxy]ethyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethoxy]ethyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethoxy]ethyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C18H38I2N2O2
MOLECULAR WEIGHT: 568.31546
SMILES: C[N+]1(CCCCC1)CCOCCOCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 111588-22-8
CAS Name: 1-ethyl-1-[2-[2-(1-ethyl-1-piperidin-1-iumyl)ethylthio]ethyl]piperidin-1-ium diiodide
OPENEYE Name: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethylsulfanyl]ethyl]piperidin-1-ium diiodide
IUPAC Name: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethylsulfanyl]ethyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethylsulfanyl]ethyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C18H38I2N2S
MOLECULAR WEIGHT: 568.38166
SMILES: CC[N+]1(CCCCC1)CCSCC[N+]2(CCCCC2)CC.[I-].[I-]
Structure:

CAS RN: 70779-09-8
CAS Name: (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3-ethoxycarbonyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester
OPENEYE Name: methyl (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3-ethoxycarbonyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
IUPAC Name: methyl (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3-ethoxycarbonyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
SYSTEMATIC NAME: methyl (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3-ethoxycarbonyloxy-10,13-dimethyl-12-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
MOLECULAR FORMULA: C28H46O6
MOLECULAR WEIGHT: 478.66124
SMILES: CCOC(=O)O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]3[C@@H]2C[C@@H]([C@]4([C@H]3CC[C@@H]4[C@H](C)CCC(=O)OC)C)O)C
Structure:

CAS RN: 145375-43-5
CAS Name: 4-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-4-oxo-2-(phenylmethyl)butanoic acid
OPENEYE Name: 4-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-2-benzyl-4-oxo-butanoic acid
IUPAC Name: 4-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-2-benzyl-4-oxobutanoic acid
SYSTEMATIC NAME: 4-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-4-oxidanylidene-2-(phenylmethyl)butanoic acid
MOLECULAR FORMULA: C19H25NO3
MOLECULAR WEIGHT: 315.4067
SMILES: C1CCC2CN(CC2C1)C(=O)CC(CC3=CC=CC=C3)C(=O)O
Structure:

CAS RN: 148564-47-0
CAS Name: 2-[[4-butyl-2-methyl-6-oxo-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1-pyrimidinyl]methyl]-3-thiophenecarboxylic acid methyl ester
OPENEYE Name: methyl 2-[[4-butyl-2-methyl-6-oxo-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrimidin-1-yl]methyl]thiophene-3-carboxylate
IUPAC Name: methyl 2-[[4-butyl-2-methyl-6-oxo-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrimidin-1-yl]methyl]thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-[[4-butyl-2-methyl-6-oxidanylidene-5-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]pyrimidin-1-yl]methyl]thiophene-3-carboxylate
MOLECULAR FORMULA: C30H30N6O3S
MOLECULAR WEIGHT: 554.6626
SMILES: CCCCC1=C(C(=O)N(C(=N1)C)CC2=C(C=CS2)C(=O)OC)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 141725-10-2
CAS Name: (2R)-2-amino-N-(2,6-dimethylphenyl)-N-[3-(3-pyridinyl)propyl]propanamide
OPENEYE Name: (2R)-2-amino-N-(2,6-dimethylphenyl)-N-[3-(3-pyridyl)propyl]propanamide
IUPAC Name: (2R)-2-amino-N-(2,6-dimethylphenyl)-N-(3-pyridin-3-ylpropyl)propanamide
SYSTEMATIC NAME: (2R)-2-azanyl-N-(2,6-dimethylphenyl)-N-(3-pyridin-3-ylpropyl)propanamide
MOLECULAR FORMULA: C19H25N3O
MOLECULAR WEIGHT: 311.4213
SMILES: CC1=C(C(=CC=C1)C)N(CCCC2=CN=CC=C2)C(=O)[C@@H](C)N
Structure:

CAS RN: 22442-07-5
CAS Name: 2-(phenylmethyl)-1-cyclooctanone
OPENEYE Name: 2-benzylcyclooctanone
IUPAC Name: 2-benzylcyclooctan-1-one
SYSTEMATIC NAME: 2-(phenylmethyl)cyclooctan-1-one
MOLECULAR FORMULA: C15H20O
MOLECULAR WEIGHT: 216.3187
SMILES: C1CCCC(=O)C(CC1)CC2=CC=CC=C2
Structure:

CAS RN: 198279-45-7
CAS Name: (5S,6R,7R)-5-(1,3-benzodioxol-5-yl)-2-butyl-7-[2-(2-carboxypropyl)-4-methoxyphenyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-6-carboxylic acid
OPENEYE Name: (5S,6R,7R)-5-(1,3-benzodioxol-5-yl)-2-butyl-7-[2-(2-carboxypropyl)-4-methoxy-phenyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-6-carboxylic acid
IUPAC Name: (5S,6R,7R)-5-(1,3-benzodioxol-5-yl)-2-butyl-7-[2-(2-carboxypropyl)-4-methoxyphenyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-6-carboxylic acid
SYSTEMATIC NAME: (5S,6R,7R)-5-(1,3-benzodioxol-5-yl)-2-butyl-7-[4-methoxy-2-(2-methyl-3-oxidanyl-3-oxidanylidene-propyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-6-carboxylic acid
MOLECULAR FORMULA: C31H33NO7
MOLECULAR WEIGHT: 531.59622
SMILES: CCCCC1=NC2=C(C=C1)[C@@H]([C@H]([C@@H]2C3=C(C=C(C=C3)OC)CC(C)C(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5
Structure:

CAS RN: 47420-28-0
CAS Name: 4-[[2-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-dioxolan-4-yl]methyl]morpholine
OPENEYE Name: 4-[[2-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-dioxolan-4-yl]methyl]morpholine
IUPAC Name: 4-[[2-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-dioxolan-4-yl]methyl]morpholine
SYSTEMATIC NAME: 4-[[2-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-dioxolan-4-yl]methyl]morpholine
MOLECULAR FORMULA: C18H27NO6
MOLECULAR WEIGHT: 353.41008
SMILES: CC1(OCC(O1)CN2CCOCC2)C3=CC(=C(C(=C3)OC)OC)OC
Structure:

CAS RN: 550-45-8
CAS Name: (1S,2S,5R)-2-methyl-5-(1-oxopropan-2-yl)-1-cyclopentanecarboxaldehyde
OPENEYE Name: (1S,2S,5R)-2-methyl-5-(1-methyl-2-oxo-ethyl)cyclopentanecarbaldehyde
IUPAC Name: (1S,2S,5R)-2-methyl-5-(1-oxopropan-2-yl)cyclopentane-1-carbaldehyde
SYSTEMATIC NAME: (1S,2S,5R)-2-methyl-5-(1-oxidanylidenepropan-2-yl)cyclopentane-1-carbaldehyde
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: C[C@H]1CC[C@@H]([C@H]1C=O)C(C)C=O
Structure:

CAS RN: 151159-23-8
CAS Name: 8-(1-aminocyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione
OPENEYE Name: 8-(1-aminocyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione
IUPAC Name: 8-(1-aminocyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 8-(1-azanylcyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione
MOLECULAR FORMULA: C16H25N5O2
MOLECULAR WEIGHT: 319.402
SMILES: CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3(CCCC3)N
Structure:

CAS RN: 27432-00-4
CAS Name: 3-(6,11-dihydrobenzo[c][1]benzazepin-5-yl)-N-methyl-1-propanamine
OPENEYE Name: 3-(6,11-dihydrobenzo[c][1]benzazepin-5-yl)-N-methyl-propan-1-amine
IUPAC Name: 3-(6,11-dihydrobenzo[c][1]benzazepin-5-yl)-N-methylpropan-1-amine
SYSTEMATIC NAME: 3-(6,11-dihydrobenzo[c][1]benzazepin-5-yl)-N-methyl-propan-1-amine
MOLECULAR FORMULA: C18H22N2
MOLECULAR WEIGHT: 266.38068
SMILES: CNCCCN1CC2=CC=CC=C2CC3=CC=CC=C31
Structure:

http://ChemLookup.com Compounds

2012-02-28T17:35:00.001-08:00

CAS RN: 137460-88-9
CAS Name: 2-[3-[1-imidazolyl(phenyl)methyl]phenyl]propanoic acid methyl ester
OPENEYE Name: methyl 2-[3-[imidazol-1-yl(phenyl)methyl]phenyl]propanoate
IUPAC Name: methyl 2-[3-[imidazol-1-yl(phenyl)methyl]phenyl]propanoate
SYSTEMATIC NAME: methyl 2-[3-[imidazol-1-yl(phenyl)methyl]phenyl]propanoate
MOLECULAR FORMULA: C20H20N2O2
MOLECULAR WEIGHT: 320.385
SMILES: CC(C1=CC=CC(=C1)C(C2=CC=CC=C2)N3C=CN=C3)C(=O)OC
Structure:

CAS RN: 86767-75-1
CAS Name: 1,1-dioxo-1,2-benzothiazol-3-one; N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]-4-pyridinimine
OPENEYE Name: 1,1-dioxo-1,2-benzothiazol-3-one; N-octyl-1-[10-(4-octylimino-1-pyridyl)decyl]pyridin-4-imine
IUPAC Name: 1,1-dioxo-1,2-benzothiazol-3-one; N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one; N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine
MOLECULAR FORMULA: C50H72N6O6S2
MOLECULAR WEIGHT: 917.27328
SMILES: CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2.C1=CC=C2C(=C1)C(=O)NS2(=O)=O.C1=CC=C2C(=C1)C(=O)NS2(=O)=O
Structure:

CAS RN: 114856-44-9
CAS Name: 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile
OPENEYE Name: 4-chloro-2-[3-[[1,1-dimethyl-2-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]ethyl]amino]-2-hydroxy-propoxy]benzonitrile
IUPAC Name: 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile
SYSTEMATIC NAME: 4-chloranyl-2-[3-[[2-methyl-1-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]propan-2-yl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile
MOLECULAR FORMULA: C25H30ClN5O3
MOLECULAR WEIGHT: 483.9904
SMILES: CC1CC(=O)NN=C1C2=CC=C(C=C2)NCC(C)(C)NCC(COC3=C(C=CC(=C3)Cl)C#N)O
Structure:

CAS RN: 139133-27-0
CAS Name: N-(ethoxymethyl)-N-methyl-2-(3-methylbutyl)-4-[(2-methyl-1-imidazo[4,5-c]pyridinyl)methyl]benzenesulfonamide
OPENEYE Name: N-(ethoxymethyl)-2-isopentyl-N-methyl-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
IUPAC Name: N-(ethoxymethyl)-N-methyl-2-(3-methylbutyl)-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
SYSTEMATIC NAME: N-(ethoxymethyl)-N-methyl-2-(3-methylbutyl)-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
MOLECULAR FORMULA: C23H32N4O3S
MOLECULAR WEIGHT: 444.59018
SMILES: CCOCN(C)S(=O)(=O)C1=C(C=C(C=C1)CN2C(=NC3=C2C=CN=C3)C)CCC(C)C
Structure:

CAS RN: 69815-49-2
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 108341-18-0
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 1377-55-5
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 34888-32-9
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 66197-74-8
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 6780-05-8
CAS Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
OPENEYE Name: 4-[(1R)-2-amino-1-hydroxy-ethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid; hydrate
SYSTEMATIC NAME: 4-[(1R)-2-azanyl-1-oxidanyl-ethyl]benzene-1,2-diol; (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; hydrate
MOLECULAR FORMULA: C12H19NO10
MOLECULAR WEIGHT: 337.27996
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:

CAS RN: 5626-36-8
CAS Name: N-nonyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
OPENEYE Name: N-nonyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
IUPAC Name: N-nonyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SYSTEMATIC NAME: N-nonyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
MOLECULAR FORMULA: C15H24N4
MOLECULAR WEIGHT: 260.37786
SMILES: CCCCCCCCCNC1=NC=NC2=C1C=CN2
Structure:

CAS RN: 155418-06-7
CAS Name: benzenesulfonate; 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]-1-piperidinyl]-2-(3-propan-2-yloxyphenyl)ethanone
OPENEYE Name: benzenesulfonate; 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenylquinuclidin-1-ium-1-yl)ethyl]-1-piperidyl]-2-(3-isopropoxyphenyl)ethanone
IUPAC Name: benzenesulfonate; 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone
SYSTEMATIC NAME: benzenesulfonate; 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone
MOLECULAR FORMULA: C43H50Cl2N2O5S
MOLECULAR WEIGHT: 777.8385
SMILES: CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC[C@](C2)(CC[N+]34CCC(CC3)(CC4)C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)Cl.C1=CC=C(C=C1)S(=O)(=O)[O-]
Structure:

CAS RN: 60734-88-5
CAS Name: methanesulfonic acid; 4-methoxybenzoic acid [2-acetyloxy-4-[2-(tert-butylamino)-1-hydroxyethyl]phenyl] ester
OPENEYE Name: [2-acetoxy-4-[2-(tert-butylamino)-1-hydroxy-ethyl]phenyl] 4-methoxybenzoate; methanesulfonic acid
IUPAC Name: [2-acetyloxy-4-[2-(tert-butylamino)-1-hydroxyethyl]phenyl] 4-methoxybenzoate; methanesulfonic acid
SYSTEMATIC NAME: [2-acetyloxy-4-[2-(tert-butylamino)-1-oxidanyl-ethyl]phenyl] 4-methoxybenzoate; methanesulfonic acid
MOLECULAR FORMULA: C23H31NO9S
MOLECULAR WEIGHT: 497.55854
SMILES: CC(=O)OC1=C(C=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C2=CC=C(C=C2)OC.CS(=O)(=O)O
Structure:

CAS RN: 128326-80-7
CAS Name: 1-[(6-methoxy-3-pyridinyl)-oxomethyl]-2-pyrrolidinone
OPENEYE Name: 1-(6-methoxypyridine-3-carbonyl)pyrrolidin-2-one
IUPAC Name: 1-(6-methoxypyridine-3-carbonyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-(6-methoxypyridin-3-yl)carbonylpyrrolidin-2-one
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: COC1=NC=C(C=C1)C(=O)N2CCCC2=O
Structure:

CAS RN: 86140-10-5
CAS Name: 1-[2-(2,6-dimethylanilino)ethylamino]-3-(1H-indazol-4-yloxy)-2-propanol
OPENEYE Name: 1-[2-(2,6-dimethylanilino)ethylamino]-3-(1H-indazol-4-yloxy)propan-2-ol
IUPAC Name: 1-[2-(2,6-dimethylanilino)ethylamino]-3-(1H-indazol-4-yloxy)propan-2-ol
SYSTEMATIC NAME: 1-[2-[(2,6-dimethylphenyl)amino]ethylamino]-3-(1H-indazol-4-yloxy)propan-2-ol
MOLECULAR FORMULA: C20H26N4O2
MOLECULAR WEIGHT: 354.44604
SMILES: CC1=C(C(=CC=C1)C)NCCNCC(COC2=CC=CC3=C2C=NN3)O
Structure:

CAS RN: 22443-11-4
CAS Name: 1-methyl-1-[2-(1-piperidinyl)ethyl]-3,4-dihydronaphthalen-2-one
OPENEYE Name: 1-methyl-1-[2-(1-piperidyl)ethyl]tetralin-2-one
IUPAC Name: 1-methyl-1-(2-piperidin-1-ylethyl)-3,4-dihydronaphthalen-2-one
SYSTEMATIC NAME: 1-methyl-1-(2-piperidin-1-ylethyl)-3,4-dihydronaphthalen-2-one
MOLECULAR FORMULA: C18H25NO
MOLECULAR WEIGHT: 271.3972
SMILES: CC1(C(=O)CCC2=CC=CC=C21)CCN3CCCCC3
Structure:

CAS RN: 99453-84-6
CAS Name: N-[2,4-dibromo-6-[[(4-hydroxycyclohexyl)amino]methyl]phenyl]-2-thiophenecarboxamide
OPENEYE Name: N-[2,4-dibromo-6-[[(4-hydroxycyclohexyl)amino]methyl]phenyl]thiophene-2-carboxamide
IUPAC Name: N-[2,4-dibromo-6-[[(4-hydroxycyclohexyl)amino]methyl]phenyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2,4-bis(bromanyl)-6-[[(4-oxidanylcyclohexyl)amino]methyl]phenyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C18H20Br2N2O2S
MOLECULAR WEIGHT: 488.2366
SMILES: C1CC(CCC1NCC2=CC(=CC(=C2NC(=O)C3=CC=CS3)Br)Br)O
Structure:

CAS RN: 103844-77-5
CAS Name: N-[[2-(4-ethylphenyl)-6-methyl-3-imidazo[1,2-a]pyridinyl]methyl]-N,3-dimethylbutanamide
OPENEYE Name: N-[[2-(4-ethylphenyl)-6-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]-N,3-dimethyl-butanamide
IUPAC Name: N-[[2-(4-ethylphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methyl]-N,3-dimethylbutanamide
SYSTEMATIC NAME: N-[[2-(4-ethylphenyl)-6-methyl-imidazo[1,2-a]pyridin-3-yl]methyl]-N,3-dimethyl-butanamide
MOLECULAR FORMULA: C23H29N3O
MOLECULAR WEIGHT: 363.49586
SMILES: CCC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CN(C)C(=O)CC(C)C
Structure:

CAS RN: 58893-38-2
CAS Name: 5-(methylaminomethyl)-3-isoxazolone
OPENEYE Name: 5-(methylaminomethyl)isoxazol-3-one
IUPAC Name: 5-(methylaminomethyl)-1,2-oxazol-3-one
SYSTEMATIC NAME: 5-(methylaminomethyl)-1,2-oxazol-3-one
MOLECULAR FORMULA: C5H8N2O2
MOLECULAR WEIGHT: 128.12922
SMILES: CNCC1=CC(=O)NO1
Structure:

CAS RN: 58893-45-1
CAS Name: 1,4,5,6,7,8-hexahydroisoxazolo[3,4-d]azepin-3-one
OPENEYE Name: 1,4,5,6,7,8-hexahydroisoxazolo[3,4-d]azepin-3-one
IUPAC Name: 1,4,5,6,7,8-hexahydro-[1,2]oxazolo[3,4-d]azepin-3-one
SYSTEMATIC NAME: 1,4,5,6,7,8-hexahydro-[1,2]oxazolo[3,4-d]azepin-3-one
MOLECULAR FORMULA: C7H10N2O2
MOLECULAR WEIGHT: 154.1665
SMILES: C1CNCCC2=C1C(=O)ON2
Structure:

CAS RN: 120819-70-7
CAS Name: 4-[oxo-[4-[[(2S,3R,4S,5S)-3,4,5-trihydroxy-2-thianyl]thio]phenyl]methyl]benzonitrile
OPENEYE Name: 4-[4-[(2S,3R,4S,5S)-3,4,5-trihydroxytetrahydrothiopyran-2-yl]sulfanylbenzoyl]benzonitrile
IUPAC Name: 4-[4-[(2S,3R,4S,5S)-3,4,5-trihydroxythian-2-yl]sulfanylbenzoyl]benzonitrile
SYSTEMATIC NAME: 4-[4-[(2S,3R,4S,5S)-3,4,5-tris(oxidanyl)thian-2-yl]sulfanylphenyl]carbonylbenzenecarbonitrile
MOLECULAR FORMULA: C19H17NO4S2
MOLECULAR WEIGHT: 387.47258
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](S1)SC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N)O)O)O
Structure:

CAS RN: 70696-66-1
CAS Name: 1-methyl-4-[1-naphthalenyl(oxo)methyl]-2-pyrrolecarboxylic acid
OPENEYE Name: 1-methyl-4-(naphthalene-1-carbonyl)pyrrole-2-carboxylic acid
IUPAC Name: 1-methyl-4-(naphthalene-1-carbonyl)pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 1-methyl-4-naphthalen-1-ylcarbonyl-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C17H13NO3
MOLECULAR WEIGHT: 279.29002
SMILES: CN1C=C(C=C1C(=O)O)C(=O)C2=CC=CC3=CC=CC=C32
Structure:

CAS RN: 84145-90-4
CAS Name: 5-(2-naphthalenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
OPENEYE Name: 5-(2-naphthyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
IUPAC Name: 5-naphthalen-2-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane
SYSTEMATIC NAME: 5-naphthalen-2-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: C1C2COC(O2)(CN1)C3=CC4=CC=CC=C4C=C3
Structure:

CAS RN: 58239-89-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H25NO2
MOLECULAR WEIGHT: 287.3966
SMILES: C[C@@]12CCN([C@@H]([C@@H]1OC)CC3=C2C=C(C=C3)O)CC4CC4
Structure:

CAS RN: 41152-17-4
CAS Name: N-[2-(4-morpholinyl)ethyl]-1-phenyl-2-propanamine
OPENEYE Name: N-(2-morpholinoethyl)-1-phenyl-propan-2-amine
IUPAC Name: N-(2-morpholin-4-ylethyl)-1-phenylpropan-2-amine
SYSTEMATIC NAME: N-(2-morpholin-4-ylethyl)-1-phenyl-propan-2-amine
MOLECULAR FORMULA: C15H24N2O
MOLECULAR WEIGHT: 248.36386
SMILES: CC(CC1=CC=CC=C1)NCCN2CCOCC2
Structure:

CAS RN: 550-01-6
CAS Name: 3-amino-2-butoxybenzoic acid 2-(diethylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(diethylamino)ethyl 3-amino-2-butoxy-benzoate hydrochloride
IUPAC Name: 2-(diethylamino)ethyl 3-amino-2-butoxybenzoate hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl 3-azanyl-2-butoxy-benzoate hydrochloride
MOLECULAR FORMULA: C17H29ClN2O3
MOLECULAR WEIGHT: 344.87676
SMILES: CCCCOC1=C(C=CC=C1N)C(=O)OCCN(CC)CC.Cl
Structure:

CAS RN: 122957-06-6
CAS Name: (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methyl-1-imidazo[4,5-c]pyridinyl)phenyl]-5-[oxo-(2-pyridinylamino)methyl]-1,4-dihydropyridine-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(2-pyridylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
IUPAC Name: ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
SYSTEMATIC NAME: ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
MOLECULAR FORMULA: C34H29ClN6O3
MOLECULAR WEIGHT: 605.08546
SMILES: CCOC(=O)C1=C(NC(=C([C@H]1C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=N3)C)C4=CC=C(C=C4)N5C(=NC6=C5C=CN=C6)C
Structure:

http://ChemLookup.com Compounds

2012-02-28T16:36:00.001-08:00

CAS RN: 5667-70-9
CAS Name: carbamic acid (4-carbamoyloxy-3-methylpentan-2-yl) ester
OPENEYE Name: (3-carbamoyloxy-1,2-dimethyl-butyl) carbamate
IUPAC Name: (4-carbamoyloxy-3-methylpentan-2-yl) carbamate
SYSTEMATIC NAME: (4-aminocarbonyloxy-3-methyl-pentan-2-yl) carbamate
MOLECULAR FORMULA: C8H16N2O4
MOLECULAR WEIGHT: 204.22364
SMILES: CC(C(C)OC(=O)N)C(C)OC(=O)N
Structure:

CAS RN: 58503-83-6
CAS Name: 2-[2-hydroxy-3-(2-methylbutan-2-ylamino)propoxy]benzonitrile
OPENEYE Name: 2-[3-(1,1-dimethylpropylamino)-2-hydroxy-propoxy]benzonitrile
IUPAC Name: 2-[2-hydroxy-3-(2-methylbutan-2-ylamino)propoxy]benzonitrile
SYSTEMATIC NAME: 2-[3-(2-methylbutan-2-ylamino)-2-oxidanyl-propoxy]benzenecarbonitrile
MOLECULAR FORMULA: C15H22N2O2
MOLECULAR WEIGHT: 262.34738
SMILES: CCC(C)(C)NCC(COC1=CC=CC=C1C#N)O
Structure:

CAS RN: 41544-42-7
CAS Name: hexanedioic acid bis(4-methylcyclohexyl) ester
OPENEYE Name: bis(4-methylcyclohexyl) hexanedioate
IUPAC Name: bis(4-methylcyclohexyl) hexanedioate
SYSTEMATIC NAME: bis(4-methylcyclohexyl) hexanedioate
MOLECULAR FORMULA: C20H34O4
MOLECULAR WEIGHT: 338.48156
SMILES: CC1CCC(CC1)OC(=O)CCCCC(=O)OC2CCC(CC2)C
Structure:

CAS RN: 34114-01-7
CAS Name: N,N-dimethyl-3-[(1,2,2,6,6-pentamethyl-4-piperidinyl)oxy]-1-propanamine; nitric acid
OPENEYE Name: N,N-dimethyl-3-[(1,2,2,6,6-pentamethyl-4-piperidyl)oxy]propan-1-amine; nitric acid
IUPAC Name: N,N-dimethyl-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-1-amine; nitric acid
SYSTEMATIC NAME: N,N-dimethyl-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy-propan-1-amine; nitric acid
MOLECULAR FORMULA: C15H34N4O7
MOLECULAR WEIGHT: 382.45306
SMILES: CC1(CC(CC(N1C)(C)C)OCCCN(C)C)C.[N+](=O)(O)[O-].[N+](=O)(O)[O-]
Structure:

CAS RN: 103238-56-8
CAS Name: 1-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]-3-(1H-indol-4-yloxy)-2-propanol
OPENEYE Name: 1-[[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]amino]-3-(1H-indol-4-yloxy)propan-2-ol
IUPAC Name: 1-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]-3-(1H-indol-4-yloxy)propan-2-ol
SYSTEMATIC NAME: 1-[[1-(1H-indol-3-yl)-2-methyl-propan-2-yl]amino]-3-(1H-indol-4-yloxy)propan-2-ol
MOLECULAR FORMULA: C23H27N3O2
MOLECULAR WEIGHT: 377.47938
SMILES: CC(C)(CC1=CNC2=CC=CC=C21)NCC(COC3=CC=CC4=C3C=CN4)O
Structure:

CAS RN: 61400-59-7
CAS Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole
OPENEYE Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole
IUPAC Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole
SYSTEMATIC NAME: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole
MOLECULAR FORMULA: C17H16Cl2N2O3
MOLECULAR WEIGHT: 367.22654
SMILES: C#CCOC[C@@H]1CO[C@@](O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl
Structure:

CAS RN: 62973-77-7
CAS Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole hydrochloride
OPENEYE Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole hydrochloride
IUPAC Name: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole hydrochloride
SYSTEMATIC NAME: 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole hydrochloride
MOLECULAR FORMULA: C17H17Cl3N2O3
MOLECULAR WEIGHT: 403.68748
SMILES: C#CCOC[C@@H]1CO[C@@](O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl.Cl
Structure:

CAS RN: 26513-79-1
CAS Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetamide
OPENEYE Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetamide
IUPAC Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetamide
SYSTEMATIC NAME: 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: C1C(=O)N(C2=CC=CC=C2O1)CC(=O)N
Structure:

CAS RN: 5585-60-4
CAS Name: 4-(9-fluorenylidenemethyl)benzenecarboximidamide hydrochloride
OPENEYE Name: 4-(fluoren-9-ylidenemethyl)benzamidine hydrochloride
IUPAC Name: 4-(fluoren-9-ylidenemethyl)benzenecarboximidamide hydrochloride
SYSTEMATIC NAME: 4-(fluoren-9-ylidenemethyl)benzenecarboximidamide hydrochloride
MOLECULAR FORMULA: C21H17ClN2
MOLECULAR WEIGHT: 332.82608
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C2=CC4=CC=C(C=C4)C(=N)N.Cl
Structure:

CAS RN: 139225-22-2
CAS Name: (5S)-5-[[4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-piperidinyl]methyl]-3-(4-methoxyphenyl)-2-oxazolidinone
OPENEYE Name: (5S)-5-[[4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-piperidyl]methyl]-3-(4-methoxyphenyl)oxazolidin-2-one
IUPAC Name: (5S)-5-[[4-(1,3-benzodioxol-5-yl)-4-hydroxypiperidin-1-yl]methyl]-3-(4-methoxyphenyl)-1,3-oxazolidin-2-one
SYSTEMATIC NAME: (5S)-5-[[4-(1,3-benzodioxol-5-yl)-4-oxidanyl-piperidin-1-yl]methyl]-3-(4-methoxyphenyl)-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C23H26N2O6
MOLECULAR WEIGHT: 426.46234
SMILES: COC1=CC=C(C=C1)N2C[C@@H](OC2=O)CN3CCC(CC3)(C4=CC5=C(C=C4)OCO5)O
Structure:

CAS RN: 18118-80-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H28O6
MOLECULAR WEIGHT: 376.44342
SMILES: CC12CC([C@H]3C([C@@H]1CC[C@@]2(C(=O)OC)O)CCC(=O)C4C3(C=CC4=O)C)O
Structure:

CAS RN: 105149-04-0
CAS Name: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-chloro-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,9,9b,10,11-octahydroindeno[4,5-h][2]benzopyran-7-one
OPENEYE Name: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-chloro-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,9,9b,10,11-octahydroindeno[4,5-h]isochromen-7-one
IUPAC Name: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5-chloro-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,9,9b,10,11-octahydroindeno[4,5-h]isochromen-7-one
SYSTEMATIC NAME: (1R,3aS,3bR,9aR,9bS,11aS)-5-chloranyl-1-ethanoyl-9a,11a-dimethyl-1-oxidanyl-2,3,3a,3b,9,9b,10,11-octahydroindeno[4,5-h]isochromen-7-one
MOLECULAR FORMULA: C20H25ClO4
MOLECULAR WEIGHT: 364.8631
SMILES: CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)OC[C@]34C)Cl)C)O
Structure:

CAS RN: 210419-36-6
CAS Name: trimethyl-[3-(1-oxoundec-10-enylamino)propyl]ammonium iodide
OPENEYE Name: trimethyl-[3-(undec-10-enoylamino)propyl]ammonium iodide
IUPAC Name: trimethyl-[3-(undec-10-enoylamino)propyl]azanium iodide
SYSTEMATIC NAME: trimethyl-[3-(undec-10-enoylamino)propyl]azanium iodide
MOLECULAR FORMULA: C17H35IN2O
MOLECULAR WEIGHT: 410.37707
SMILES: C[N+](C)(C)CCCNC(=O)CCCCCCCCC=C.[I-]
Structure:

CAS RN: 176894-09-0
CAS Name: 2-[(3R,4S)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-piperidinyl]-1-(4-fluorophenyl)ethanone
OPENEYE Name: 2-[(3R,4S)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-piperidyl]-1-(4-fluorophenyl)ethanone
IUPAC Name: 2-[(3R,4S)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]-1-(4-fluorophenyl)ethanone
SYSTEMATIC NAME: 2-[(3R,4S)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]-1-(4-fluorophenyl)ethanone
MOLECULAR FORMULA: C27H25F2NO4
MOLECULAR WEIGHT: 465.488506
SMILES: C1CN(C[C@@H]([C@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4)CC(=O)C5=CC=C(C=C5)F
Structure:

CAS RN: 95382-33-5
CAS Name: magnesium 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole
OPENEYE Name: magnesium 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole
IUPAC Name: magnesium 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
SYSTEMATIC NAME: magnesium 6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole
MOLECULAR FORMULA: C34H38MgN6O6S2+2
MOLECULAR WEIGHT: 715.13712
SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC.CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC.[Mg+2]
Structure:

http://ChemLookup.com Compounds

2012-02-28T15:36:00.001-08:00

CAS RN: 63868-58-6
CAS Name: 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine hydrochloride
OPENEYE Name: 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine hydrochloride
IUPAC Name: 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine hydrochloride
SYSTEMATIC NAME: 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine hydrochloride
MOLECULAR FORMULA: C19H22Cl3NO2
MOLECULAR WEIGHT: 402.74248
SMILES: C1COCCN1CCOC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl.Cl
Structure:

CAS RN: 63868-57-5
CAS Name: [4-methoxy-3,5-bis(phenylmethoxy)phenyl]-(4-morpholinyl)methanone
OPENEYE Name: (3,5-dibenzyloxy-4-methoxy-phenyl)-morpholino-methanone
IUPAC Name: [4-methoxy-3,5-bis(phenylmethoxy)phenyl]-morpholin-4-ylmethanone
SYSTEMATIC NAME: [4-methoxy-3,5-bis(phenylmethoxy)phenyl]-morpholin-4-yl-methanone
MOLECULAR FORMULA: C26H27NO5
MOLECULAR WEIGHT: 433.49628
SMILES: COC1=C(C=C(C=C1OCC2=CC=CC=C2)C(=O)N3CCOCC3)OCC4=CC=CC=C4
Structure:

CAS RN: 63868-53-1
CAS Name: (2-butyl-4-morpholinyl)-(3,4,5-trimethoxyphenyl)methanone
OPENEYE Name: (2-butylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
IUPAC Name: (2-butylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
SYSTEMATIC NAME: (2-butylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
MOLECULAR FORMULA: C18H27NO5
MOLECULAR WEIGHT: 337.41068
SMILES: CCCCC1CN(CCO1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC
Structure:

CAS RN: 63868-52-0
CAS Name: (3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-morpholinyl)methanone
OPENEYE Name: (4-benzyloxy-3,5-dimethoxy-phenyl)-morpholino-methanone
IUPAC Name: (3,5-dimethoxy-4-phenylmethoxyphenyl)-morpholin-4-ylmethanone
SYSTEMATIC NAME: (3,5-dimethoxy-4-phenylmethoxy-phenyl)-morpholin-4-yl-methanone
MOLECULAR FORMULA: C20H23NO5
MOLECULAR WEIGHT: 357.40032
SMILES: COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(=O)N3CCOCC3
Structure:

CAS RN: 63868-51-9
CAS Name: (2-amino-3,4,5-trimethoxyphenyl)-(4-morpholinyl)methanone; 4-methylbenzenesulfonic acid
OPENEYE Name: (2-amino-3,4,5-trimethoxy-phenyl)-morpholino-methanone; 4-methylbenzenesulfonic acid
IUPAC Name: (2-amino-3,4,5-trimethoxyphenyl)-morpholin-4-ylmethanone; 4-methylbenzenesulfonic acid
SYSTEMATIC NAME: (2-azanyl-3,4,5-trimethoxy-phenyl)-morpholin-4-yl-methanone; 4-methylbenzenesulfonic acid
MOLECULAR FORMULA: C21H28N2O8S
MOLECULAR WEIGHT: 468.52062
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.COC1=C(C(=C(C(=C1)C(=O)N2CCOCC2)N)OC)OC
Structure:

CAS RN: 63868-49-5
CAS Name: acetic acid [2,6-dimethoxy-4-[4-morpholinyl(oxo)methyl]phenyl] ester
OPENEYE Name: [2,6-dimethoxy-4-(morpholine-4-carbonyl)phenyl] acetate
IUPAC Name: [2,6-dimethoxy-4-(morpholine-4-carbonyl)phenyl] acetate
SYSTEMATIC NAME: (2,6-dimethoxy-4-morpholin-4-ylcarbonyl-phenyl) ethanoate
MOLECULAR FORMULA: C15H19NO6
MOLECULAR WEIGHT: 309.31446
SMILES: CC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCOCC2)OC
Structure:

CAS RN: 63868-48-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H32BrNO
MOLECULAR WEIGHT: 442.43168
SMILES: C[N+]1(CCC23CCCC[C@H]2C1CC4=C3C=C(C=C4)O)CCC5=CC=CC=C5.[Br-]
Structure:

CAS RN: 59840-71-0
CAS Name: N,N-dimethylcarbamic acid 2-[4-(4-oxo-4-thiophen-2-ylbutyl)-1-piperazinyl]ethyl ester
OPENEYE Name: 2-[4-[4-oxo-4-(2-thienyl)butyl]piperazin-1-yl]ethyl N,N-dimethylcarbamate
IUPAC Name: 2-[4-(4-oxo-4-thiophen-2-ylbutyl)piperazin-1-yl]ethyl N,N-dimethylcarbamate
SYSTEMATIC NAME: 2-[4-(4-oxidanylidene-4-thiophen-2-yl-butyl)piperazin-1-yl]ethyl N,N-dimethylcarbamate
MOLECULAR FORMULA: C17H27N3O3S
MOLECULAR WEIGHT: 353.47958
SMILES: CN(C)C(=O)OCCN1CCN(CC1)CCCC(=O)C2=CC=CS2
Structure:

CAS RN: 17243-65-1
CAS Name: bis[3-(2,5-dimethyl-1-pyrrolidinyl)propyl]-hexadecyl-methylammonium bromide
OPENEYE Name: bis[3-(2,5-dimethylpyrrolidin-1-yl)propyl]-hexadecyl-methyl-ammonium bromide
IUPAC Name: bis[3-(2,5-dimethylpyrrolidin-1-yl)propyl]-hexadecyl-methylazanium bromide
SYSTEMATIC NAME: bis[3-(2,5-dimethylpyrrolidin-1-yl)propyl]-hexadecyl-methyl-azanium bromide
MOLECULAR FORMULA: C35H72BrN3
MOLECULAR WEIGHT: 614.87028
SMILES: CCCCCCCCCCCCCCCC[N+](C)(CCCN1C(CCC1C)C)CCCN2C(CCC2C)C.[Br-]
Structure:

CAS RN: 82509-56-6
CAS Name: (2S,5R,6R)-6-[[(2R)-2-(4-hydroxyphenyl)-1-oxo-2-[[oxo-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]amino]methyl]amino]ethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
OPENEYE Name: (2S,5R,6R)-6-[[(2R)-2-(4-hydroxyphenyl)-2-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]carbamoylamino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-(4-hydroxyphenyl)-2-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]carbamoylamino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (2S,5R,6R)-6-[[(2R)-2-(4-hydroxyphenyl)-2-[[6-oxidanylidene-2-[(4-sulfamoylphenyl)amino]-1H-pyrimidin-5-yl]carbamoylamino]ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C27H28N8O9S2
MOLECULAR WEIGHT: 672.68942
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)NC(=O)NC4=CN=C(NC4=O)NC5=CC=C(C=C5)S(=O)(=O)N)C(=O)O)C
Structure:

CAS RN: 35620-67-8
CAS Name: 1,1-dimethyl-2-[[(4-methylphenyl)-phenylmethoxy]methyl]piperidin-1-ium bromide
OPENEYE Name: 1,1-dimethyl-2-[[phenyl(p-tolyl)methoxy]methyl]piperidin-1-ium bromide
IUPAC Name: 1,1-dimethyl-2-[[(4-methylphenyl)-phenylmethoxy]methyl]piperidin-1-ium bromide
SYSTEMATIC NAME: 1,1-dimethyl-2-[[(4-methylphenyl)-phenyl-methoxy]methyl]piperidin-1-ium bromide
MOLECULAR FORMULA: C22H30BrNO
MOLECULAR WEIGHT: 404.3837
SMILES: CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC3CCCC[N+]3(C)C.[Br-]
Structure:

CAS RN: 82209-39-0
CAS Name: 2-(2-oxo-1-pyrrolidinyl)acetic acid (3,3,5-trimethylcyclohexyl) ester
OPENEYE Name: (3,3,5-trimethylcyclohexyl) 2-(2-oxopyrrolidin-1-yl)acetate
IUPAC Name: (3,3,5-trimethylcyclohexyl) 2-(2-oxopyrrolidin-1-yl)acetate
SYSTEMATIC NAME: (3,3,5-trimethylcyclohexyl) 2-(2-oxidanylidenepyrrolidin-1-yl)ethanoate
MOLECULAR FORMULA: C15H25NO3
MOLECULAR WEIGHT: 267.3639
SMILES: CC1CC(CC(C1)(C)C)OC(=O)CN2CCCC2=O
Structure:

CAS RN: 42408-78-6
CAS Name: N,N-dimethyl-2-(1-methyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)ethanamine hydrochloride
OPENEYE Name: N,N-dimethyl-2-(1-methyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)ethanamine hydrochloride
IUPAC Name: N,N-dimethyl-2-(1-methyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)ethanamine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-2-(1-methyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)ethanamine hydrochloride
MOLECULAR FORMULA: C17H24ClNO
MOLECULAR WEIGHT: 293.83156
SMILES: CC1(C2=C(CCO1)C3=CC=CC=C3C2)CCN(C)C.Cl
Structure:

CAS RN: 55313-67-2
CAS Name: 2-[1-[2-(2-chlorophenyl)ethyl]-4-hydroxy-4-piperidinyl]-N-cyclohexyl-N-methylpropanamide
OPENEYE Name: 2-[1-[2-(2-chlorophenyl)ethyl]-4-hydroxy-4-piperidyl]-N-cyclohexyl-N-methyl-propanamide
IUPAC Name: 2-[1-[2-(2-chlorophenyl)ethyl]-4-hydroxypiperidin-4-yl]-N-cyclohexyl-N-methylpropanamide
SYSTEMATIC NAME: 2-[1-[2-(2-chlorophenyl)ethyl]-4-oxidanyl-piperidin-4-yl]-N-cyclohexyl-N-methyl-propanamide
MOLECULAR FORMULA: C23H35ClN2O2
MOLECULAR WEIGHT: 406.9892
SMILES: CC(C(=O)N(C)C1CCCCC1)C2(CCN(CC2)CCC3=CC=CC=C3Cl)O
Structure:

CAS RN: 150893-08-6
CAS Name: 4-[[[2-amino-4-(methylamino)-6-quinazolinyl]-methylamino]methyl]benzonitrile
OPENEYE Name: 4-[[[2-amino-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzonitrile
IUPAC Name: 4-[[[2-amino-4-(methylamino)quinazolin-6-yl]-methylamino]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[[2-azanyl-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C18H18N6
MOLECULAR WEIGHT: 318.37572
SMILES: CNC1=NC(=NC2=C1C=C(C=C2)N(C)CC3=CC=C(C=C3)C#N)N
Structure:

CAS RN: 28240-18-8
CAS Name: 2,2-diphenylacetic acid 2-(1-methyl-2-piperidinyl)propan-2-yl ester
OPENEYE Name: [1-methyl-1-(1-methyl-2-piperidyl)ethyl] 2,2-diphenylacetate
IUPAC Name: 2-(1-methylpiperidin-2-yl)propan-2-yl 2,2-diphenylacetate
SYSTEMATIC NAME: 2-(1-methylpiperidin-2-yl)propan-2-yl 2,2-diphenylethanoate
MOLECULAR FORMULA: C23H29NO2
MOLECULAR WEIGHT: 351.48186
SMILES: CC(C)(C1CCCCN1C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 578-89-2
CAS Name: 3-hydroxy-N-methyl-2-phenyl-N-(3-pyridinylmethyl)propanamide
OPENEYE Name: 3-hydroxy-N-methyl-2-phenyl-N-(3-pyridylmethyl)propanamide
IUPAC Name: 3-hydroxy-N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)propanamide
SYSTEMATIC NAME: N-methyl-3-oxidanyl-2-phenyl-N-(pyridin-3-ylmethyl)propanamide
MOLECULAR FORMULA: C16H18N2O2
MOLECULAR WEIGHT: 270.32632
SMILES: CN(CC1=CN=CC=C1)C(=O)C(CO)C2=CC=CC=C2
Structure:

CAS RN: 79992-71-5
CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]ethanethioic acid S-(3-pyridinylmethyl) ester
OPENEYE Name: S-(3-pyridylmethyl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]ethanethioate
IUPAC Name: S-(pyridin-3-ylmethyl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethanethioate
SYSTEMATIC NAME: S-(pyridin-3-ylmethyl) 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanethioate
MOLECULAR FORMULA: C25H21ClN2O3S
MOLECULAR WEIGHT: 464.96384
SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)SCC4=CN=CC=C4
Structure:

CAS RN: 15686-87-0
CAS Name: 2,2-diphenyl-3-(2-piperidinyl)propanoic acid ethyl ester
OPENEYE Name: ethyl 2,2-diphenyl-3-(2-piperidyl)propanoate
IUPAC Name: ethyl 2,2-diphenyl-3-piperidin-2-ylpropanoate
SYSTEMATIC NAME: ethyl 2,2-diphenyl-3-piperidin-2-yl-propanoate
MOLECULAR FORMULA: C22H27NO2
MOLECULAR WEIGHT: 337.45528
SMILES: CCOC(=O)C(CC1CCCCN1)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 138506-45-3
CAS Name: (2S)-5-oxo-2-pyrrolidinecarboxylic acid (4-hydroxyphenyl) ester
OPENEYE Name: (4-hydroxyphenyl) (2S)-5-oxopyrrolidine-2-carboxylate
IUPAC Name: (4-hydroxyphenyl) (2S)-5-oxopyrrolidine-2-carboxylate
SYSTEMATIC NAME: (4-hydroxyphenyl) (2S)-5-oxidanylidenepyrrolidine-2-carboxylate
MOLECULAR FORMULA: C11H11NO4
MOLECULAR WEIGHT: 221.20934
SMILES: C1CC(=O)N[C@@H]1C(=O)OC2=CC=C(C=C2)O
Structure:

CAS RN: 5988-22-7
CAS Name: disodium [2-methyl-4-phosphonooxy-3-(3,7,11,15-tetramethylhexadecyl)-1-naphthalenyl] phosphate
OPENEYE Name: disodium [2-methyl-4-phosphonooxy-3-(3,7,11,15-tetramethylhexadecyl)-1-naphthyl] phosphate
IUPAC Name: disodium [2-methyl-4-phosphonooxy-3-(3,7,11,15-tetramethylhexadecyl)naphthalen-1-yl] phosphate
SYSTEMATIC NAME: disodium [2-methyl-4-phosphonooxy-3-(3,7,11,15-tetramethylhexadecyl)naphthalen-1-yl] phosphate
MOLECULAR FORMULA: C31H50Na2O8P2
MOLECULAR WEIGHT: 658.650962
SMILES: CC1=C(C2=CC=CC=C2C(=C1CCC(C)CCCC(C)CCCC(C)CCCC(C)C)OP(=O)(O)O)OP(=O)([O-])[O-].[Na+].[Na+]
Structure:

CAS RN: 485-24-5
CAS Name: 2-[[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]anilino]-oxomethyl]benzoic acid
OPENEYE Name: 2-[[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
IUPAC Name: 2-[[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
SYSTEMATIC NAME: 2-[[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
MOLECULAR FORMULA: C17H14N4O5S2
MOLECULAR WEIGHT: 418.44686
SMILES: CC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O
Structure:

CAS RN: 110390-84-6
CAS Name: 7-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]butyl]-1,3-dimethylpurine-2,6-dione
OPENEYE Name: 7-[4-[4-(4-fluorobenzoyl)-1-piperidyl]butyl]-1,3-dimethyl-purine-2,6-dione
IUPAC Name: 7-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 7-[4-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]butyl]-1,3-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C23H28FN5O3
MOLECULAR WEIGHT: 441.498523
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F
Structure:

CAS RN: 29952-13-4
CAS Name: 2,4-dimethyl-5-[4-[4-(4-methyl-2-thiazolyl)-1-piperazinyl]butyl]thiazole
OPENEYE Name: 2,4-dimethyl-5-[4-[4-(4-methylthiazol-2-yl)piperazin-1-yl]butyl]thiazole
IUPAC Name: 2,4-dimethyl-5-[4-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]butyl]-1,3-thiazole
SYSTEMATIC NAME: 2,4-dimethyl-5-[4-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]butyl]-1,3-thiazole
MOLECULAR FORMULA: C17H26N4S2
MOLECULAR WEIGHT: 350.54514
SMILES: CC1=CSC(=N1)N2CCN(CC2)CCCCC3=C(N=C(S3)C)C
Structure:

CAS RN: 35265-50-0
CAS Name: 6,7-dimethoxy-2-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-1H-quinazolin-4-one
OPENEYE Name: 6,7-dimethoxy-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one
IUPAC Name: 6,7-dimethoxy-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one
SYSTEMATIC NAME: 6,7-dimethoxy-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one
MOLECULAR FORMULA: C23H28N4O4
MOLECULAR WEIGHT: 424.49282
SMILES: COC1=CC=CC=C1N2CCN(CC2)CCC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC
Structure:

CAS RN: 72444-62-3
CAS Name: 1-phenyl-3-(1-piperazinyl)isoquinoline
OPENEYE Name: 1-phenyl-3-piperazin-1-yl-isoquinoline
IUPAC Name: 1-phenyl-3-piperazin-1-ylisoquinoline
SYSTEMATIC NAME: 1-phenyl-3-piperazin-1-yl-isoquinoline
MOLECULAR FORMULA: C19H19N3
MOLECULAR WEIGHT: 289.37426
SMILES: C1CN(CCN1)C2=CC3=CC=CC=C3C(=N2)C4=CC=CC=C4
Structure:

CAS RN: 7001-56-1
CAS Name: 1-[(8R,9S,10R,13S,14S,17R)-3-cyclopentyloxy-17-hydroxy-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone
OPENEYE Name: 1-[(8R,9S,10R,13S,14S,17R)-3-(cyclopentoxy)-17-hydroxy-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone
IUPAC Name: 1-[(8R,9S,10R,13S,14S,17R)-3-cyclopentyloxy-17-hydroxy-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone
SYSTEMATIC NAME: 1-[(8R,9S,10R,13S,14S,17R)-3-cyclopentyloxy-10,13-dimethyl-17-oxidanyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone
MOLECULAR FORMULA: C26H38O3
MOLECULAR WEIGHT: 398.57812
SMILES: CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC(=C4)OC5CCCC5)C)C)O
Structure:

CAS RN: 65634-39-1
CAS Name: 2-fluoro-4-[5,5,5-trifluoro-3-(3-fluoro-4-hydroxyphenyl)pentan-2-yl]phenol
OPENEYE Name: 2-fluoro-4-[4,4,4-trifluoro-2-(3-fluoro-4-hydroxy-phenyl)-1-methyl-butyl]phenol
IUPAC Name: 2-fluoro-4-[5,5,5-trifluoro-3-(3-fluoro-4-hydroxyphenyl)pentan-2-yl]phenol
SYSTEMATIC NAME: 2-fluoranyl-4-[5,5,5-tris(fluoranyl)-3-(3-fluoranyl-4-oxidanyl-phenyl)pentan-2-yl]phenol
MOLECULAR FORMULA: C17H15F5O2
MOLECULAR WEIGHT: 346.291816
SMILES: CC(C1=CC(=C(C=C1)O)F)C(CC(F)(F)F)C2=CC(=C(C=C2)O)F
Structure:

CAS RN: 7085-39-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H5NO
MOLECULAR WEIGHT: 131.1314
SMILES: C1C2=C3C(=C1C=C2)OC=N3
Structure:

CAS RN: 77-12-3
CAS Name: chloromethane; 6-[methyl-[2-(4-methyl-4-morpholin-4-iumyl)ethyl]amino]-2,2-diphenylhexanenitrile; chloride
OPENEYE Name: chloromethane; 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile; chloride
IUPAC Name: chloromethane; 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenylhexanenitrile; chloride
SYSTEMATIC NAME: chloranylmethane; 6-[methyl-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]amino]-2,2-diphenyl-hexanenitrile; chloride
MOLECULAR FORMULA: C27H39Cl2N3O
MOLECULAR WEIGHT: 492.52406
SMILES: CN(CCCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)CC[N+]3(CCOCC3)C.CCl.[Cl-]
Structure:

http://ChemLookup.com Compounds

2012-02-28T14:36:00.001-08:00

CAS RN: 63868-81-5
CAS Name: 2-(3-methyl-1-pyridin-1-iumyl)-1-[4-[2-(3-methyl-1-pyridin-1-iumyl)-1-oxoethyl]phenyl]ethanone dibromide
OPENEYE Name: 2-(3-methylpyridin-1-ium-1-yl)-1-[4-[2-(3-methylpyridin-1-ium-1-yl)acetyl]phenyl]ethanone dibromide
IUPAC Name: 2-(3-methylpyridin-1-ium-1-yl)-1-[4-[2-(3-methylpyridin-1-ium-1-yl)acetyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 2-(3-methylpyridin-1-ium-1-yl)-1-[4-[2-(3-methylpyridin-1-ium-1-yl)ethanoyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C22H22Br2N2O2
MOLECULAR WEIGHT: 506.23028
SMILES: CC1=C[N+](=CC=C1)CC(=O)C2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C.[Br-].[Br-]
Structure:

CAS RN: 63868-80-4
CAS Name: 2-(2-methyl-1-pyridin-1-iumyl)-1-[4-[2-(2-methyl-1-pyridin-1-iumyl)-1-oxoethyl]phenyl]ethanone dibromide
OPENEYE Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[4-[2-(2-methylpyridin-1-ium-1-yl)acetyl]phenyl]ethanone dibromide
IUPAC Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[4-[2-(2-methylpyridin-1-ium-1-yl)acetyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 2-(2-methylpyridin-1-ium-1-yl)-1-[4-[2-(2-methylpyridin-1-ium-1-yl)ethanoyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C22H22Br2N2O2
MOLECULAR WEIGHT: 506.23028
SMILES: CC1=CC=CC=[N+]1CC(=O)C2=CC=C(C=C2)C(=O)C[N+]3=CC=CC=C3C.[Br-].[Br-]
Structure:

CAS RN: 63868-79-1
CAS Name: 1-(3-methyl-1-pyridin-1-iumyl)-4-[4-[2-(3-methyl-1-pyridin-1-iumyl)-1-oxoethyl]phenyl]-2-butanone dibromide
OPENEYE Name: 1-(3-methylpyridin-1-ium-1-yl)-4-[4-[2-(3-methylpyridin-1-ium-1-yl)acetyl]phenyl]butan-2-one dibromide
IUPAC Name: 1-(3-methylpyridin-1-ium-1-yl)-4-[4-[2-(3-methylpyridin-1-ium-1-yl)acetyl]phenyl]butan-2-one dibromide
SYSTEMATIC NAME: 1-(3-methylpyridin-1-ium-1-yl)-4-[4-[2-(3-methylpyridin-1-ium-1-yl)ethanoyl]phenyl]butan-2-one dibromide
MOLECULAR FORMULA: C24H26Br2N2O2
MOLECULAR WEIGHT: 534.28344
SMILES: CC1=C[N+](=CC=C1)CC(=O)CCC2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C.[Br-].[Br-]
Structure:

CAS RN: 63868-78-0
CAS Name: 1-(2-methyl-1-pyridin-1-iumyl)-4-[4-[2-(2-methyl-1-pyridin-1-iumyl)-1-oxoethyl]phenyl]-2-butanone dibromide
OPENEYE Name: 1-(2-methylpyridin-1-ium-1-yl)-4-[4-[2-(2-methylpyridin-1-ium-1-yl)acetyl]phenyl]butan-2-one dibromide
IUPAC Name: 1-(2-methylpyridin-1-ium-1-yl)-4-[4-[2-(2-methylpyridin-1-ium-1-yl)acetyl]phenyl]butan-2-one dibromide
SYSTEMATIC NAME: 1-(2-methylpyridin-1-ium-1-yl)-4-[4-[2-(2-methylpyridin-1-ium-1-yl)ethanoyl]phenyl]butan-2-one dibromide
MOLECULAR FORMULA: C24H26Br2N2O2
MOLECULAR WEIGHT: 534.28344
SMILES: CC1=CC=CC=[N+]1CC(=O)CCC2=CC=C(C=C2)C(=O)C[N+]3=CC=CC=C3C.[Br-].[Br-]
Structure:

CAS RN: 63868-77-9
CAS Name: 2-[3-[2-(diethylamino)ethylthio]propyl]isoindole-1,3-dione
OPENEYE Name: 2-[3-[2-(diethylamino)ethylsulfanyl]propyl]isoindoline-1,3-dione
IUPAC Name: 2-[3-[2-(diethylamino)ethylsulfanyl]propyl]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[3-[2-(diethylamino)ethylsulfanyl]propyl]isoindole-1,3-dione
MOLECULAR FORMULA: C17H24N2O2S
MOLECULAR WEIGHT: 320.44966
SMILES: CCN(CC)CCSCCCN1C(=O)C2=CC=CC=C2C1=O
Structure:

CAS RN: 63868-76-8
CAS Name: (4-methyl-1-phthalazinyl)hydrazine hydrochloride
OPENEYE Name: (4-methylphthalazin-1-yl)hydrazine hydrochloride
IUPAC Name: (4-methylphthalazin-1-yl)hydrazine hydrochloride
SYSTEMATIC NAME: (4-methylphthalazin-1-yl)diazane hydrochloride
MOLECULAR FORMULA: C9H11ClN4
MOLECULAR WEIGHT: 210.66344
SMILES: CC1=NN=C(C2=CC=CC=C12)NN.Cl
Structure:

CAS RN: 63868-74-6
CAS Name: 3-(3,3-dimethyl-1H-isobenzofuran-1-yl)-N-methyl-1-propanamine; oxalic acid
OPENEYE Name: 3-(3,3-dimethyl-1H-isobenzofuran-1-yl)-N-methyl-propan-1-amine; oxalic acid
IUPAC Name: 3-(3,3-dimethyl-1H-2-benzofuran-1-yl)-N-methylpropan-1-amine; oxalic acid
SYSTEMATIC NAME: 3-(3,3-dimethyl-1H-2-benzofuran-1-yl)-N-methyl-propan-1-amine; ethanedioic acid
MOLECULAR FORMULA: C16H23NO5
MOLECULAR WEIGHT: 309.35752
SMILES: CC1(C2=CC=CC=C2C(O1)CCCNC)C.C(=O)(C(=O)O)O
Structure:

CAS RN: 63868-73-5
CAS Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)-1-propanamine; oxalic acid
OPENEYE Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)propan-1-amine; oxalic acid
IUPAC Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine; oxalic acid
SYSTEMATIC NAME: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine; ethanedioic acid
MOLECULAR FORMULA: C22H27NO5
MOLECULAR WEIGHT: 385.45348
SMILES: CC1C2=CC=CC=C2C(O1)(CCCN(C)C)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63868-72-4
CAS Name: 3-(1-cyclohexyl-3,3-dimethyl-1-isobenzofuranyl)-N,N-dimethyl-1-propanamine; oxalic acid
OPENEYE Name: 3-(1-cyclohexyl-3,3-dimethyl-isobenzofuran-1-yl)-N,N-dimethyl-propan-1-amine; oxalic acid
IUPAC Name: 3-(1-cyclohexyl-3,3-dimethyl-2-benzofuran-1-yl)-N,N-dimethylpropan-1-amine; oxalic acid
SYSTEMATIC NAME: 3-(1-cyclohexyl-3,3-dimethyl-2-benzofuran-1-yl)-N,N-dimethyl-propan-1-amine; ethanedioic acid
MOLECULAR FORMULA: C23H35NO5
MOLECULAR WEIGHT: 405.5277
SMILES: CC1(C2=CC=CC=C2C(O1)(CCCN(C)C)C3CCCCC3)C.C(=O)(C(=O)O)O
Structure:

CAS RN: 63868-71-3
CAS Name: 1-[3-(dimethylamino)propyl]-3,3-dimethyl-1-isobenzofuranol; oxalic acid
OPENEYE Name: 1-[3-(dimethylamino)propyl]-3,3-dimethyl-isobenzofuran-1-ol; oxalic acid
IUPAC Name: 1-[3-(dimethylamino)propyl]-3,3-dimethyl-2-benzofuran-1-ol; oxalic acid
SYSTEMATIC NAME: 1-[3-(dimethylamino)propyl]-3,3-dimethyl-2-benzofuran-1-ol; ethanedioic acid
MOLECULAR FORMULA: C17H25NO6
MOLECULAR WEIGHT: 339.3835
SMILES: CC1(C2=CC=CC=C2C(O1)(CCCN(C)C)O)C.C(=O)(C(=O)O)O
Structure:

CAS RN: 63868-69-9
CAS Name: 2-(3,3-dimethyl-1-phenyl-1-isobenzofuranyl)-N-methylethanamine; oxalic acid
OPENEYE Name: 2-(3,3-dimethyl-1-phenyl-isobenzofuran-1-yl)-N-methyl-ethanamine; oxalic acid
IUPAC Name: 2-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)-N-methylethanamine; oxalic acid
SYSTEMATIC NAME: 2-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)-N-methyl-ethanamine; ethanedioic acid
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CC1(C2=CC=CC=C2C(O1)(CCNC)C3=CC=CC=C3)C.C(=O)(C(=O)O)O
Structure:

CAS RN: 63868-68-8
CAS Name: (4-hydroxy-3,5-dimethoxyphenyl)-(4-morpholinyl)methanone
OPENEYE Name: (4-hydroxy-3,5-dimethoxy-phenyl)-morpholino-methanone
IUPAC Name: (4-hydroxy-3,5-dimethoxyphenyl)-morpholin-4-ylmethanone
SYSTEMATIC NAME: (3,5-dimethoxy-4-oxidanyl-phenyl)-morpholin-4-yl-methanone
MOLECULAR FORMULA: C13H17NO5
MOLECULAR WEIGHT: 267.27778
SMILES: COC1=CC(=CC(=C1O)OC)C(=O)N2CCOCC2
Structure:

CAS RN: 63868-67-7
CAS Name: 4-morpholinyl-(3,4,5-trihydroxyphenyl)methanone
OPENEYE Name: morpholino-(3,4,5-trihydroxyphenyl)methanone
IUPAC Name: morpholin-4-yl-(3,4,5-trihydroxyphenyl)methanone
SYSTEMATIC NAME: morpholin-4-yl-[3,4,5-tris(oxidanyl)phenyl]methanone
MOLECULAR FORMULA: C11H13NO5
MOLECULAR WEIGHT: 239.22462
SMILES: C1COCCN1C(=O)C2=CC(=C(C(=C2)O)O)O
Structure:

CAS RN: 63868-66-6
CAS Name: (2-ethyl-4-morpholinyl)-(3,4,5-trimethoxyphenyl)methanone
OPENEYE Name: (2-ethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
IUPAC Name: (2-ethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
SYSTEMATIC NAME: (2-ethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
MOLECULAR FORMULA: C16H23NO5
MOLECULAR WEIGHT: 309.35752
SMILES: CCC1CN(CCO1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC
Structure:

CAS RN: 63868-65-5
CAS Name: 4-[6-(diphenylmethyl)oxyhexyl]morpholine hydrochloride
OPENEYE Name: 4-(6-benzhydryloxyhexyl)morpholine hydrochloride
IUPAC Name: 4-(6-benzhydryloxyhexyl)morpholine hydrochloride
SYSTEMATIC NAME: 4-[6-(diphenylmethyl)oxyhexyl]morpholine hydrochloride
MOLECULAR FORMULA: C23H32ClNO2
MOLECULAR WEIGHT: 389.95868
SMILES: C1COCCN1CCCCCCOC(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:

CAS RN: 63868-64-4
CAS Name: 4-[oxo-(3,4,5-trimethoxyphenyl)methyl]morpholine-3,5-dione
OPENEYE Name: 4-(3,4,5-trimethoxybenzoyl)morpholine-3,5-dione
IUPAC Name: 4-(3,4,5-trimethoxybenzoyl)morpholine-3,5-dione
SYSTEMATIC NAME: 4-(3,4,5-trimethoxyphenyl)carbonylmorpholine-3,5-dione
MOLECULAR FORMULA: C14H15NO7
MOLECULAR WEIGHT: 309.2714
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=O)COCC2=O
Structure:

CAS RN: 63868-63-3
CAS Name: (2,3-dimethyl-4-morpholinyl)-(3,4,5-trimethoxyphenyl)methanone
OPENEYE Name: (2,3-dimethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
IUPAC Name: (2,3-dimethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
SYSTEMATIC NAME: (2,3-dimethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
MOLECULAR FORMULA: C16H23NO5
MOLECULAR WEIGHT: 309.35752
SMILES: CC1C(OCCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C
Structure:

CAS RN: 63868-61-1
CAS Name: (5-ethyl-2,3-dimethyl-4-morpholinyl)-(3,4,5-trimethoxyphenyl)methanone
OPENEYE Name: (5-ethyl-2,3-dimethyl-morpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
IUPAC Name: (5-ethyl-2,3-dimethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
SYSTEMATIC NAME: (5-ethyl-2,3-dimethyl-morpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
MOLECULAR FORMULA: C18H27NO5
MOLECULAR WEIGHT: 337.41068
SMILES: CCC1COC(C(N1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C)C
Structure:

CAS RN: 63868-60-0
CAS Name: [2-(dimethylamino)-3,4,5-trimethoxyphenyl]-(4-morpholinyl)methanone
OPENEYE Name: [2-(dimethylamino)-3,4,5-trimethoxy-phenyl]-morpholino-methanone
IUPAC Name: [2-(dimethylamino)-3,4,5-trimethoxyphenyl]-morpholin-4-ylmethanone
SYSTEMATIC NAME: [2-(dimethylamino)-3,4,5-trimethoxy-phenyl]-morpholin-4-yl-methanone
MOLECULAR FORMULA: C16H24N2O5
MOLECULAR WEIGHT: 324.37216
SMILES: CN(C)C1=C(C(=C(C=C1C(=O)N2CCOCC2)OC)OC)OC
Structure:

CAS RN: 63868-59-7
CAS Name: (3,5-dimethoxy-4-propoxyphenyl)-(4-morpholinyl)methanone
OPENEYE Name: (3,5-dimethoxy-4-propoxy-phenyl)-morpholino-methanone
IUPAC Name: (3,5-dimethoxy-4-propoxyphenyl)-morpholin-4-ylmethanone
SYSTEMATIC NAME: (3,5-dimethoxy-4-propoxy-phenyl)-morpholin-4-yl-methanone
MOLECULAR FORMULA: C16H23NO5
MOLECULAR WEIGHT: 309.35752
SMILES: CCCOC1=C(C=C(C=C1OC)C(=O)N2CCOCC2)OC
Structure:

http://ChemLookup.com Compounds

2012-02-28T13:36:00.001-08:00

CAS RN: 63869-85-2
CAS Name: thorium(4+) tetrachloride heptahydrate
OPENEYE Name: thorium(4+) tetrachloride heptahydrate
IUPAC Name: thorium(4+) tetrachloride heptahydrate
SYSTEMATIC NAME: thorium(4+) tetrachloride heptahydrate
MOLECULAR FORMULA: Cl4H14O7Th
MOLECULAR WEIGHT: 499.95706
SMILES: O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Cl-].[Th+4]
Structure:

CAS RN: 63869-84-1
CAS Name: 1-methyl-4-[3-(9H-thioxanthen-9-yl)propyl]piperazine dihydrochloride
OPENEYE Name: 1-methyl-4-[3-(9H-thioxanthen-9-yl)propyl]piperazine dihydrochloride
IUPAC Name: 1-methyl-4-[3-(9H-thioxanthen-9-yl)propyl]piperazine dihydrochloride
SYSTEMATIC NAME: 1-methyl-4-[3-(9H-thioxanthen-9-yl)propyl]piperazine dihydrochloride
MOLECULAR FORMULA: C21H28Cl2N2S
MOLECULAR WEIGHT: 411.43142
SMILES: CN1CCN(CC1)CCCC2C3=CC=CC=C3SC4=CC=CC=C24.Cl.Cl
Structure:

CAS RN: 63869-83-0
CAS Name: 1-methyl-4-[3-(9-thioxanthenylidene)propyl]piperazine dihydrochloride
OPENEYE Name: 1-methyl-4-(3-thioxanthen-9-ylidenepropyl)piperazine dihydrochloride
IUPAC Name: 1-methyl-4-(3-thioxanthen-9-ylidenepropyl)piperazine dihydrochloride
SYSTEMATIC NAME: 1-methyl-4-(3-thioxanthen-9-ylidenepropyl)piperazine dihydrochloride
MOLECULAR FORMULA: C21H26Cl2N2S
MOLECULAR WEIGHT: 409.41554
SMILES: CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=CC=CC=C42.Cl.Cl
Structure:

CAS RN: 63869-74-9
CAS Name: 2-[4-[3-(2,7-dichloro-9-thioxanthenylidene)propyl]-1-piperazinyl]ethanol dihydrochloride
OPENEYE Name: 2-[4-[3-(2,7-dichlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol dihydrochloride
IUPAC Name: 2-[4-[3-(2,7-dichlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol dihydrochloride
SYSTEMATIC NAME: 2-[4-[3-[2,7-bis(chloranyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol dihydrochloride
MOLECULAR FORMULA: C22H26Cl4N2OS
MOLECULAR WEIGHT: 508.33164
SMILES: C1CN(CCN1CCC=C2C3=C(C=CC(=C3)Cl)SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl
Structure:

CAS RN: 63869-73-8
CAS Name: 3-(2,7-dichloro-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: 3-(2,7-dichlorothioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: 3-(2,7-dichlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: 3-[2,7-bis(chloranyl)thioxanthen-9-ylidene]-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C18H18Cl3NS
MOLECULAR WEIGHT: 386.76622
SMILES: CN(C)CCC=C1C2=C(C=CC(=C2)Cl)SC3=C1C=C(C=C3)Cl.Cl
Structure:

CAS RN: 63869-72-7
CAS Name: 3-(2,7-dibromo-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: 3-(2,7-dibromothioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: 3-(2,7-dibromothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: 3-[2,7-bis(bromanyl)thioxanthen-9-ylidene]-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C18H18Br2ClNS
MOLECULAR WEIGHT: 475.66822
SMILES: CN(C)CCC=C1C2=C(C=CC(=C2)Br)SC3=C1C=C(C=C3)Br.Cl
Structure:

CAS RN: 63869-60-3
CAS Name: 3-(2-chloro-9H-thioxanthen-9-yl)-N,N-dimethyl-1-propanamine hydrobromide
OPENEYE Name: 3-(2-chloro-9H-thioxanthen-9-yl)-N,N-dimethyl-propan-1-amine hydrobromide
IUPAC Name: 3-(2-chloro-9H-thioxanthen-9-yl)-N,N-dimethylpropan-1-amine hydrobromide
SYSTEMATIC NAME: 3-(2-chloranyl-9H-thioxanthen-9-yl)-N,N-dimethyl-propan-1-amine hydrobromide
MOLECULAR FORMULA: C18H21BrClNS
MOLECULAR WEIGHT: 398.78804
SMILES: CN(C)CCCC1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Br
Structure:

CAS RN: 63869-54-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H22ClNO2
MOLECULAR WEIGHT: 295.80438
SMILES: CC(=O)OC1C2CC(CCN2C)(C3=CC=CC=C13)C.Cl
Structure:

CAS RN: 63869-53-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H22BrNO2
MOLECULAR WEIGHT: 340.25538
SMILES: CC(=O)O[C@@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2C)C.Br
Structure:

CAS RN: 63869-52-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H28ClNO2
MOLECULAR WEIGHT: 337.88412
SMILES: CC[C@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CC)C=C(C=C3)OC(=O)C.Cl
Structure:

CAS RN: 63869-51-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H29NO
MOLECULAR WEIGHT: 299.45036
SMILES: CCC12CCN(C(C1)C(C3=C2C=C(C=C3)O)C)CC4CCC4
Structure:

CAS RN: 63869-50-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28N2O
MOLECULAR WEIGHT: 336.47052
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=C(C=C4)N)C)C=C(C=C3)O
Structure:

CAS RN: 63869-49-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H32BrNO
MOLECULAR WEIGHT: 442.43168
SMILES: CC1C2CC3=C(C1(CC[N+]2(CCC4=CC=CC=C4)CC=C)C)C=C(C=C3)O.[Br-]
Structure:

CAS RN: 63869-48-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H20ClN
MOLECULAR WEIGHT: 237.7683
SMILES: CC12CCN(C(C1)CC3=CC=CC=C23)C.Cl
Structure:

CAS RN: 63869-47-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H29NO
MOLECULAR WEIGHT: 299.45036
SMILES: CC1C2CC3=C(C1(CCN2CC4CCC4)C)C=C(C=C3)OC
Structure:

CAS RN: 63869-46-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H28ClNO
MOLECULAR WEIGHT: 369.92752
SMILES: C[C@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2CCC(=O)C4=CC=CC=C4)C.Cl
Structure:

CAS RN: 63869-45-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H18ClNO
MOLECULAR WEIGHT: 251.75182
SMILES: CC12CCN(C(C1)C(=O)C3=CC=CC=C23)C.Cl
Structure:

CAS RN: 63869-44-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H26ClNO2
MOLECULAR WEIGHT: 359.88964
SMILES: C[C@@]12CCN([C@H]([C@H]1O)CC3=C2C=C(C=C3)O)CCC4=CC=CC=C4.Cl
Structure:

CAS RN: 63869-43-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H26BrNO2
MOLECULAR WEIGHT: 404.34064
SMILES: C[C@@]1([C@H]2CCN([C@H]1CC3=C2C=C(C=C3)O)CCC4=CC=CC=C4)O.Br
Structure:

CAS RN: 63869-42-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22ClNO2
MOLECULAR WEIGHT: 283.79368
SMILES: CC[C@@]12CCN([C@H]([C@@H]1O)CC3=C2C=C(C=C3)O)C.Cl
Structure:

CAS RN: 63869-41-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H26ClNO4
MOLECULAR WEIGHT: 367.86704
SMILES: CC[C@@]12CCN([C@H]([C@H]1OC(=O)C)CC3=C2C=C(C=C3)OC(=O)C)C.Cl
Structure:

CAS RN: 63869-40-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H28ClNO4
MOLECULAR WEIGHT: 381.89362
SMILES: CC[C@@]12CCN([C@H]([C@@]1(C)OC(=O)C)CC3=C2C=C(C=C3)OC(=O)C)C.Cl
Structure:

CAS RN: 63869-39-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H26ClNO3
MOLECULAR WEIGHT: 339.85694
SMILES: CC[C@@]12CCN([C@H]([C@@]1(C)O)CC3=C2C=C(C=C3)OC(=O)C)C.Cl
Structure:

CAS RN: 63869-38-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H24BrNO4
MOLECULAR WEIGHT: 398.29146
SMILES: CC(=O)O[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)OC(=O)C.Br
Structure:

CAS RN: 63869-37-4
CAS Name: 2-nitro-1,3-dipropoxy-2-(propoxymethyl)propane
OPENEYE Name: 2-nitro-1,3-dipropoxy-2-(propoxymethyl)propane
IUPAC Name: 2-nitro-1,3-dipropoxy-2-(propoxymethyl)propane
SYSTEMATIC NAME: 2-nitro-1,3-dipropoxy-2-(propoxymethyl)propane
MOLECULAR FORMULA: C13H27NO5
MOLECULAR WEIGHT: 277.35718
SMILES: CCCOCC(COCCC)(COCCC)[N+](=O)[O-]
Structure:

CAS RN: 63869-31-8
CAS Name: [[(4-chlorophenyl)thio]methylthio]-ethoxy-ethyl-sulfanylidenephosphorane
OPENEYE Name: (4-chlorophenyl)sulfanylmethylsulfanyl-ethoxy-ethyl-thioxo-$l^{5}-phosphane
IUPAC Name: (4-chlorophenyl)sulfanylmethylsulfanyl-ethoxy-ethyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: (4-chlorophenyl)sulfanylmethylsulfanyl-ethoxy-ethyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C11H16ClOPS3
MOLECULAR WEIGHT: 326.865901
SMILES: CCOP(=S)(CC)SCSC1=CC=C(C=C1)Cl
Structure:

CAS RN: 63869-29-4
CAS Name: 1-[ethoxy-(4-nitrophenoxy)phosphoryl]-4-propylbenzene
OPENEYE Name: 1-[ethoxy-(4-nitrophenoxy)phosphoryl]-4-propyl-benzene
IUPAC Name: 1-[ethoxy-(4-nitrophenoxy)phosphoryl]-4-propylbenzene
SYSTEMATIC NAME: 1-[ethoxy-(4-nitrophenoxy)phosphoryl]-4-propyl-benzene
MOLECULAR FORMULA: C17H20NO5P
MOLECULAR WEIGHT: 349.318161
SMILES: CCCC1=CC=C(C=C1)P(=O)(OCC)OC2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 63869-28-3
CAS Name: [dimethoxyphosphoryl-(dimethoxyphosphorylthio)methylidene]-trimethoxyphosphorane
OPENEYE Name: [dimethoxyphosphoryl(dimethoxyphosphorylsulfanyl)methylene]-trimethoxy-$l^{5}-phosphane
IUPAC Name: [dimethoxyphosphoryl(dimethoxyphosphorylsulfanyl)methylidene]-trimethoxy-$l^{5}-phosphane
SYSTEMATIC NAME: [dimethoxyphosphoryl(dimethoxyphosphorylsulfanyl)methylidene]-trimethoxy-$l^{5}-phosphane
MOLECULAR FORMULA: C8H21O9P3S
MOLECULAR WEIGHT: 386.233223
SMILES: COP(=C(P(=O)(OC)OC)SP(=O)(OC)OC)(OC)OC
Structure:

CAS RN: 63869-27-2
CAS Name: 1-[[bis(diethoxyphosphoryl)-(diethoxyphosphorylthio)methyl]-ethoxyphosphoryl]oxyethane
OPENEYE Name: 1-[[bis(diethoxyphosphoryl)-diethoxyphosphorylsulfanyl-methyl]-ethoxy-phosphoryl]oxyethane
IUPAC Name: 1-[[bis(diethoxyphosphoryl)-diethoxyphosphorylsulfanylmethyl]-ethoxyphosphoryl]oxyethane
SYSTEMATIC NAME: 1-[[bis(diethoxyphosphoryl)-diethoxyphosphorylsulfanyl-methyl]-ethoxy-phosphoryl]oxyethane
MOLECULAR FORMULA: C17H40O12P4S
MOLECULAR WEIGHT: 592.452344
SMILES: CCOP(=O)(C(P(=O)(OCC)OCC)(P(=O)(OCC)OCC)SP(=O)(OCC)OCC)OCC
Structure:

CAS RN: 63869-26-1
CAS Name: [(diethoxyphosphorylmethyldisulfanyl)methylthio]methanethioic acid O-ethyl ester
OPENEYE Name: O-ethyl (diethoxyphosphorylmethyldisulfanyl)methylsulfanylmethanethioate
IUPAC Name: O-ethyl (diethoxyphosphorylmethyldisulfanyl)methylsulfanylmethanethioate
SYSTEMATIC NAME: O-ethyl (diethoxyphosphorylmethyldisulfanyl)methylsulfanylmethanethioate
MOLECULAR FORMULA: C9H19O4PS4
MOLECULAR WEIGHT: 350.478521
SMILES: CCOC(=S)SCSSCP(=O)(OCC)OCC
Structure:

CAS RN: 63869-24-9
CAS Name: phosphoric acid 1-diethoxyphosphorylethenyl dimethyl ester
OPENEYE Name: 1-diethoxyphosphorylvinyl dimethyl phosphate
IUPAC Name: 1-diethoxyphosphorylethenyl dimethyl phosphate
SYSTEMATIC NAME: 1-diethoxyphosphorylethenyl dimethyl phosphate
MOLECULAR FORMULA: C8H18O7P2
MOLECULAR WEIGHT: 288.171842
SMILES: CCOP(=O)(C(=C)OP(=O)(OC)OC)OCC
Structure:

CAS RN: 63869-22-7
CAS Name: [[bis(diethoxyphosphoryl)-(ethylthio)methyl]thio]benzene
OPENEYE Name: [bis(diethoxyphosphoryl)-ethylsulfanyl-methyl]sulfanylbenzene
IUPAC Name: [bis(diethoxyphosphoryl)-ethylsulfanylmethyl]sulfanylbenzene
SYSTEMATIC NAME: [bis(diethoxyphosphoryl)-ethylsulfanyl-methyl]sulfanylbenzene
MOLECULAR FORMULA: C17H30O6P2S2
MOLECULAR WEIGHT: 456.494022
SMILES: CCOP(=O)(C(P(=O)(OCC)OCC)(SCC)SC1=CC=CC=C1)OCC
Structure:

CAS RN: 63869-10-3
CAS Name: 2-methyl-2-propenoic acid 2-methylprop-1-enyl ester
OPENEYE Name: 2-methylprop-1-enyl 2-methylprop-2-enoate
IUPAC Name: 2-methylprop-1-enyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-methylprop-1-enyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: CC(=COC(=O)C(=C)C)C
Structure:

CAS RN: 63869-08-9
CAS Name: phenyl-[12-[12-(phenylmercurio)dodecylthio]dodecyl]mercury
OPENEYE Name: phenyl-[12-[12-(phenylmercurio)dodecylsulfanyl]dodecyl]mercury
IUPAC Name: phenyl-[12-[12-(phenylmercurio)dodecylsulfanyl]dodecyl]mercury
SYSTEMATIC NAME: phenyl-[12-[12-(phenylmercurio)dodecylsulfanyl]dodecyl]mercury
MOLECULAR FORMULA: C36H58Hg2S
MOLECULAR WEIGHT: 924.09072
SMILES: C1=CC=C(C=C1)[Hg]CCCCCCCCCCCCSCCCCCCCCCCCC[Hg]C2=CC=CC=C2
Structure:

CAS RN: 63869-07-8
CAS Name: methyl-(4-methyl-N-(2-methyl-5-propan-2-ylphenyl)sulfonylanilino)mercury
OPENEYE Name: (N-(5-isopropyl-2-methyl-phenyl)sulfonyl-4-methyl-anilino)-methyl-mercury
IUPAC Name: methyl-(4-methyl-N-(2-methyl-5-propan-2-ylphenyl)sulfonylanilino)mercury
SYSTEMATIC NAME: methyl-[(4-methylphenyl)-(2-methyl-5-propan-2-yl-phenyl)sulfonyl-amino]mercury
MOLECULAR FORMULA: C18H23HgNO2S
MOLECULAR WEIGHT: 518.03572
SMILES: CC1=CC=C(C=C1)N(S(=O)(=O)C2=C(C=CC(=C2)C(C)C)C)[Hg]C
Structure:

CAS RN: 63869-05-6
CAS Name: [bis-(4-methylphenyl)sulfonylamino]-methylmercury
OPENEYE Name: [bis(p-tolylsulfonyl)amino]-methyl-mercury
IUPAC Name: [bis-(4-methylphenyl)sulfonylamino]-methylmercury
SYSTEMATIC NAME: [bis-(4-methylphenyl)sulfonylamino]-methyl-mercury
MOLECULAR FORMULA: C15H17HgNO4S2
MOLECULAR WEIGHT: 540.01978
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(S(=O)(=O)C2=CC=C(C=C2)C)[Hg]C
Structure:

CAS RN: 63868-92-8
CAS Name: 3-(hydroxythio)-1,2,4-triazine-6-carboxylic acid
OPENEYE Name: 3-hydroxysulfanyl-1,2,4-triazine-6-carboxylic acid
IUPAC Name: 3-hydroxysulfanyl-1,2,4-triazine-6-carboxylic acid
SYSTEMATIC NAME: 3-oxidanylsulfanyl-1,2,4-triazine-6-carboxylic acid
MOLECULAR FORMULA: C4H3N3O3S
MOLECULAR WEIGHT: 173.14992
SMILES: C1=C(N=NC(=N1)SO)C(=O)O
Structure:

CAS RN: 63868-89-3
CAS Name: 2-[(4-methyl-1-piperazinyl)methylthio]ethanethiol
OPENEYE Name: 2-[(4-methylpiperazin-1-yl)methylsulfanyl]ethanethiol
IUPAC Name: 2-[(4-methylpiperazin-1-yl)methylsulfanyl]ethanethiol
SYSTEMATIC NAME: 2-[(4-methylpiperazin-1-yl)methylsulfanyl]ethanethiol
MOLECULAR FORMULA: C8H18N2S2
MOLECULAR WEIGHT: 206.37192
SMILES: CN1CCN(CC1)CSCCS
Structure:

CAS RN: 63868-85-9
CAS Name: 2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)thio]ethanamine hydrochloride
OPENEYE Name: 2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)sulfanyl]ethanamine hydrochloride
IUPAC Name: 2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)sulfanyl]ethanamine hydrochloride
SYSTEMATIC NAME: 2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)sulfanyl]ethanamine hydrochloride
MOLECULAR FORMULA: C8H17ClN2S
MOLECULAR WEIGHT: 208.75198
SMILES: CN1CCC(=CC1)SCCN.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T12:36:00.001-08:00

CAS RN: 63870-08-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H26BrNO
MOLECULAR WEIGHT: 388.34124
SMILES: CC12CCN(C(C1)CC3=C2C=C(C=C3)O)CCC4=CC=CC=C4.Br
Structure:

CAS RN: 63870-07-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24ClNO
MOLECULAR WEIGHT: 281.82086
SMILES: CCCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C.Cl
Structure:

CAS RN: 63870-06-4
CAS Name: N-methyl-2-(4-phenyldiazenylphenoxy)-N-[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
OPENEYE Name: N-methyl-2-(4-phenylazophenoxy)-N-[2-(4-phenylazophenoxy)ethyl]ethanamine
IUPAC Name: N-methyl-2-(4-phenyldiazenylphenoxy)-N-[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
SYSTEMATIC NAME: N-methyl-2-(4-phenyldiazenylphenoxy)-N-[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
MOLECULAR FORMULA: C29H29N5O2
MOLECULAR WEIGHT: 479.57286
SMILES: CN(CCOC1=CC=C(C=C1)N=NC2=CC=CC=C2)CCOC3=CC=C(C=C3)N=NC4=CC=CC=C4
Structure:

CAS RN: 63870-01-9
CAS Name: 4-methyl-3H-1,5-benzothiazepin-2-one
OPENEYE Name: 4-methyl-3H-1,5-benzothiazepin-2-one
IUPAC Name: 4-methyl-3H-1,5-benzothiazepin-2-one
SYSTEMATIC NAME: 4-methyl-3H-1,5-benzothiazepin-2-one
MOLECULAR FORMULA: C10H9NOS
MOLECULAR WEIGHT: 191.24956
SMILES: CC1=NC2=CC=CC=C2SC(=O)C1
Structure:

CAS RN: 63869-99-8
CAS Name: 2-(1-ethyl-1-piperidin-1-iumyl)-N-[2-(1-ethyl-1-piperidin-1-iumyl)ethyl]-N-methylethanamine dibromide
OPENEYE Name: 2-(1-ethylpiperidin-1-ium-1-yl)-N-[2-(1-ethylpiperidin-1-ium-1-yl)ethyl]-N-methyl-ethanamine dibromide
IUPAC Name: 2-(1-ethylpiperidin-1-ium-1-yl)-N-[2-(1-ethylpiperidin-1-ium-1-yl)ethyl]-N-methylethanamine dibromide
SYSTEMATIC NAME: 2-(1-ethylpiperidin-1-ium-1-yl)-N-[2-(1-ethylpiperidin-1-ium-1-yl)ethyl]-N-methyl-ethanamine dibromide
MOLECULAR FORMULA: C19H41Br2N3
MOLECULAR WEIGHT: 471.35694
SMILES: CC[N+]1(CCCCC1)CCN(C)CC[N+]2(CCCCC2)CC.[Br-].[Br-]
Structure:

CAS RN: 63869-98-7
CAS Name: N-methyl-2-(4-methyl-4-morpholin-4-iumyl)-N-[2-(4-methyl-4-morpholin-4-iumyl)ethyl]ethanamine dibromide
OPENEYE Name: N-methyl-2-(4-methylmorpholin-4-ium-4-yl)-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]ethanamine dibromide
IUPAC Name: N-methyl-2-(4-methylmorpholin-4-ium-4-yl)-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]ethanamine dibromide
SYSTEMATIC NAME: N-methyl-2-(4-methylmorpholin-4-ium-4-yl)-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]ethanamine dibromide
MOLECULAR FORMULA: C15H33Br2N3O2
MOLECULAR WEIGHT: 447.24942
SMILES: CN(CC[N+]1(CCOCC1)C)CC[N+]2(CCOCC2)C.[Br-].[Br-]
Structure:

CAS RN: 63869-97-6
CAS Name: N-methyl-2-(1-methyl-1-pyrrolidin-1-iumyl)-N-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethyl]ethanamine dibromide
OPENEYE Name: N-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]ethanamine dibromide
IUPAC Name: N-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]ethanamine dibromide
SYSTEMATIC NAME: N-methyl-2-(1-methylpyrrolidin-1-ium-1-yl)-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]ethanamine dibromide
MOLECULAR FORMULA: C15H33Br2N3
MOLECULAR WEIGHT: 415.25062
SMILES: CN(CC[N+]1(CCCC1)C)CC[N+]2(CCCC2)C.[Br-].[Br-]
Structure:

CAS RN: 63869-96-5
CAS Name: 3-methyl-1,2,3,4-tetrahydropyrido[3,2-b]indole-5-carboxylic acid
OPENEYE Name: 3-methyl-1,2,3,4-tetrahydropyrido[3,2-b]indole-5-carboxylic acid
IUPAC Name: 3-methyl-1,2,3,4-tetrahydropyrido[3,2-b]indole-5-carboxylic acid
SYSTEMATIC NAME: 3-methyl-1,2,3,4-tetrahydropyrido[3,2-b]indole-5-carboxylic acid
MOLECULAR FORMULA: C13H14N2O2
MOLECULAR WEIGHT: 230.26246
SMILES: CC1CC2=C(C3=CC=CC=C3N2C(=O)O)NC1
Structure:

CAS RN: 63869-94-3
CAS Name: 6-methyl-3-[(6-methyl-2,4-dioxo-3-oxanyl)methyl]oxane-2,4-dione
OPENEYE Name: 6-methyl-3-[(6-methyl-2,4-dioxo-tetrahydropyran-3-yl)methyl]tetrahydropyran-2,4-dione
IUPAC Name: 6-methyl-3-[(6-methyl-2,4-dioxooxan-3-yl)methyl]oxane-2,4-dione
SYSTEMATIC NAME: 6-methyl-3-[[6-methyl-2,4-bis(oxidanylidene)oxan-3-yl]methyl]oxane-2,4-dione
MOLECULAR FORMULA: C13H16O6
MOLECULAR WEIGHT: 268.26254
SMILES: CC1CC(=O)C(C(=O)O1)CC2C(=O)CC(OC2=O)C
Structure:

CAS RN: 63869-92-1
CAS Name: acetic acid [3-[[3-hydroxy-4-methoxy-6-methyl-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-14-yl] ester
OPENEYE Name: [3-[3-hydroxy-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-14-yl] acetate
IUPAC Name: [3-[3-hydroxy-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-14-yl] acetate
SYSTEMATIC NAME: [3-[5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-methoxy-6-methyl-3-oxidanyl-oxan-2-yl]oxy-10,13-dimethyl-17-(5-oxidanylidene-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-14-yl] ethanoate
MOLECULAR FORMULA: C38H58O14
MOLECULAR WEIGHT: 738.85872
SMILES: CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)OC(=O)C)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O
Structure:

CAS RN: 63869-91-0
CAS Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; thulium(3+)
OPENEYE Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; thulium(3+)
IUPAC Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; thulium(3+)
SYSTEMATIC NAME: 2-[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate; hydron; thulium(3+)
MOLECULAR FORMULA: C10H13N2O8Tm
MOLECULAR WEIGHT: 458.15303
SMILES: [H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Tm+3]
Structure:

CAS RN: 63869-89-6
CAS Name: 1-(2-hydroxyethyl)-3-[2-[[(2-hydroxyethylamino)-oxomethyl]amino]-3-methylphenyl]urea
OPENEYE Name: 1-(2-hydroxyethyl)-3-[2-(2-hydroxyethylcarbamoylamino)-3-methyl-phenyl]urea
IUPAC Name: 1-(2-hydroxyethyl)-3-[2-(2-hydroxyethylcarbamoylamino)-3-methylphenyl]urea
SYSTEMATIC NAME: 1-(2-hydroxyethyl)-3-[2-(2-hydroxyethylcarbamoylamino)-3-methyl-phenyl]urea
MOLECULAR FORMULA: C13H20N4O4
MOLECULAR WEIGHT: 296.3223
SMILES: CC1=C(C(=CC=C1)NC(=O)NCCO)NC(=O)NCCO
Structure:

CAS RN: 63869-88-5
CAS Name: 1-(1-aziridinyl)-3-[2-[[(1-aziridinylamino)-oxomethyl]amino]-3-methylphenyl]urea
OPENEYE Name: 1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methyl-phenyl]urea
IUPAC Name: 1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methylphenyl]urea
SYSTEMATIC NAME: 1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methyl-phenyl]urea
MOLECULAR FORMULA: C13H18N6O2
MOLECULAR WEIGHT: 290.32102
SMILES: CC1=C(C(=CC=C1)NC(=O)NN2CC2)NC(=O)NN3CC3
Structure:

CAS RN: 63869-86-3
CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; thulium(3+)
OPENEYE Name: thulium(3+) citrate
IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; thulium(3+)
SYSTEMATIC NAME: 2-oxidanylpropane-1,2,3-tricarboxylate; thulium(3+)
MOLECULAR FORMULA: C6H5O7Tm
MOLECULAR WEIGHT: 358.03391
SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Tm+3]
Structure:

http://ChemLookup.com Compounds

2012-02-28T11:36:00.001-08:00

CAS RN: 63884-30-0
CAS Name: 4-[2-(1,1-dimethyl-4-piperidin-1-iumyl)ethyl]-4-methylmorpholin-4-ium diiodide
OPENEYE Name: 4-[2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl]-4-methyl-morpholin-4-ium diiodide
IUPAC Name: 4-[2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl]-4-methylmorpholin-4-ium diiodide
SYSTEMATIC NAME: 4-[2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl]-4-methyl-morpholin-4-ium diiodide
MOLECULAR FORMULA: C14H30I2N2O
MOLECULAR WEIGHT: 496.20974
SMILES: C[N+]1(CCC(CC1)CC[N+]2(CCOCC2)C)C.[I-].[I-]
Structure:

CAS RN: 63884-28-6
CAS Name: 1-methyl-1-[10-(1-methyl-1-piperidin-1-iumyl)decyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[10-(1-methylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[10-(1-methylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[10-(1-methylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C22H46I2N2
MOLECULAR WEIGHT: 592.42298
SMILES: C[N+]1(CCCCC1)CCCCCCCCCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 63884-27-5
CAS Name: 1-ethyl-1-[10-(1-ethyl-1-piperidin-1-iumyl)decyl]piperidin-1-ium dibromide
OPENEYE Name: 1-ethyl-1-[10-(1-ethylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium dibromide
IUPAC Name: 1-ethyl-1-[10-(1-ethylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium dibromide
SYSTEMATIC NAME: 1-ethyl-1-[10-(1-ethylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium dibromide
MOLECULAR FORMULA: C24H50Br2N2
MOLECULAR WEIGHT: 526.4752
SMILES: CC[N+]1(CCCCC1)CCCCCCCCCC[N+]2(CCCCC2)CC.[Br-].[Br-]
Structure:

CAS RN: 63884-25-3
CAS Name: propanoic acid [4-[4-(1-methyl-1-piperidin-1-iumyl)butyl]phenyl] ester iodide
OPENEYE Name: [4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide
IUPAC Name: [4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide
SYSTEMATIC NAME: [4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide
MOLECULAR FORMULA: C19H30INO2
MOLECULAR WEIGHT: 431.35147
SMILES: CCC(=O)OC1=CC=C(C=C1)CCCC[N+]2(CCCCC2)C.[I-]
Structure:

CAS RN: 63884-24-2
CAS Name: 1,4-bis(2-chloroethyl)-1,4-diethylpiperazine-1,4-diium dichloride
OPENEYE Name: 1,4-bis(2-chloroethyl)-1,4-diethyl-piperazine-1,4-diium dichloride
IUPAC Name: 1,4-bis(2-chloroethyl)-1,4-diethylpiperazine-1,4-diium dichloride
SYSTEMATIC NAME: 1,4-bis(2-chloroethyl)-1,4-diethyl-piperazine-1,4-diium dichloride
MOLECULAR FORMULA: C12H26Cl4N2
MOLECULAR WEIGHT: 340.16024
SMILES: CC[N+]1(CC[N+](CC1)(CC)CCCl)CCCl.[Cl-].[Cl-]
Structure:

CAS RN: 63884-23-1
CAS Name: 1-methyl-1-[2-[4-[4-[2-(1-methyl-4-oxo-1-piperidin-1-iumyl)-2-oxoethyl]phenyl]phenyl]-1-oxoethyl]-4-piperidin-1-iumone dibromide
OPENEYE Name: 1-methyl-1-[2-[4-[4-[2-(1-methyl-4-oxo-piperidin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]acetyl]piperidin-1-ium-4-one dibromide
IUPAC Name: 1-methyl-1-[2-[4-[4-[2-(1-methyl-4-oxopiperidin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]acetyl]piperidin-1-ium-4-one dibromide
SYSTEMATIC NAME: 1-methyl-1-[2-[4-[4-[2-(1-methyl-4-oxidanylidene-piperidin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanoyl]piperidin-1-ium-4-one dibromide
MOLECULAR FORMULA: C28H34Br2N2O4
MOLECULAR WEIGHT: 622.38856
SMILES: C[N+]1(CCC(=O)CC1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4(CCC(=O)CC4)C.[Br-].[Br-]
Structure:

CAS RN: 63884-22-0
CAS Name: 1-[4-(hydroxymethyl)-1-piperidin-1-iumyl]-2-[4-[4-[2-[4-(hydroxymethyl)-1-piperidin-1-iumyl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C28H38Br2N2O4
MOLECULAR WEIGHT: 626.42032
SMILES: C1C[NH+](CCC1CO)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[NH+]4CCC(CC4)CO.[Br-].[Br-]
Structure:

CAS RN: 63884-21-9
CAS Name: 1-(1-methyl-1-piperidin-1-iumyl)-2-[4-[4-[2-(1-methyl-1-piperidin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone diiodide
OPENEYE Name: 1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[4-[2-(1-methylpiperidin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone diiodide
IUPAC Name: 1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[4-[2-(1-methylpiperidin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone diiodide
SYSTEMATIC NAME: 1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[4-[2-(1-methylpiperidin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone diiodide
MOLECULAR FORMULA: C28H38I2N2O2
MOLECULAR WEIGHT: 688.42246
SMILES: C[N+]1(CCCCC1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4(CCCCC4)C.[I-].[I-]
Structure:

CAS RN: 63882-42-8
CAS Name: 2-(2-methylphenyl)-1-cyclohexanone
OPENEYE Name: 2-(o-tolyl)cyclohexanone
IUPAC Name: 2-(2-methylphenyl)cyclohexan-1-one
SYSTEMATIC NAME: 2-(2-methylphenyl)cyclohexan-1-one
MOLECULAR FORMULA: C13H16O
MOLECULAR WEIGHT: 188.26554
SMILES: CC1=CC=CC=C1C2CCCCC2=O
Structure:

CAS RN: 63874-69-1
CAS Name: 2-[2-(2-methylpropoxy)phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid
OPENEYE Name: 2-(2-isobutoxyphenyl)-6-oxo-1H-pyrimidine-5-carboxylic acid
IUPAC Name: 2-[2-(2-methylpropoxy)phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid
SYSTEMATIC NAME: 2-[2-(2-methylpropoxy)phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid
MOLECULAR FORMULA: C15H16N2O4
MOLECULAR WEIGHT: 288.29854
SMILES: CC(C)COC1=CC=CC=C1C2=NC=C(C(=O)N2)C(=O)O
Structure:

CAS RN: 63873-23-4
CAS Name: diethoxy-propan-2-yloxy-sulfanylidenephosphorane
OPENEYE Name: diethoxy-isopropoxy-thioxo-$l^{5}-phosphane
IUPAC Name: diethoxy-propan-2-yloxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: diethoxy-propan-2-yloxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C7H17O3PS
MOLECULAR WEIGHT: 212.246841
SMILES: CCOP(=S)(OCC)OC(C)C
Structure:

CAS RN: 63873-21-2
CAS Name: 2-(diethoxyphosphorylthio)propane
OPENEYE Name: 2-diethoxyphosphorylsulfanylpropane
IUPAC Name: 2-diethoxyphosphorylsulfanylpropane
SYSTEMATIC NAME: 2-diethoxyphosphorylsulfanylpropane
MOLECULAR FORMULA: C7H17O3PS
MOLECULAR WEIGHT: 212.246841
SMILES: CCOP(=O)(OCC)SC(C)C
Structure:

CAS RN: 63870-17-7
CAS Name: trisodium; 2-hydroxypropane-1,2,3-tricarboxylate; thorium(4+); tetranitrate
OPENEYE Name: trisodium thorium(4+) citrate tetranitrate
IUPAC Name: trisodium; 2-hydroxypropane-1,2,3-tricarboxylate; thorium(4+); tetranitrate
SYSTEMATIC NAME: trisodium; 2-oxidanylpropane-1,2,3-tricarboxylate; thorium(4+); tetranitrate
MOLECULAR FORMULA: C6H5N4Na3O19Th
MOLECULAR WEIGHT: 738.12671
SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Na+].[Na+].[Na+].[Th+4]
Structure:

CAS RN: 63870-16-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H28ClNO3
MOLECULAR WEIGHT: 353.88352
SMILES: CC[C@@]12CCN([C@H]([C@@]1(C)OC(=O)C)CC3=C2C=C(C=C3)OC)C.Cl
Structure:

CAS RN: 63870-15-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H20BrNO
MOLECULAR WEIGHT: 298.2187
SMILES: C[C@@]12CCN([C@H]([C@H]1O)CC3=CC=CC=C23)C.Br
Structure:

CAS RN: 63870-14-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H25NO
MOLECULAR WEIGHT: 271.3972
SMILES: CC1C2CC3=C(C1(CCN2CC(=C)C)C)C=C(C=C3)O
Structure:

CAS RN: 63870-13-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H30BrNO2
MOLECULAR WEIGHT: 444.4045
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)OC(=O)C.Br
Structure:

CAS RN: 63870-12-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H30N2O2
MOLECULAR WEIGHT: 426.55
SMILES: C[C@H]1[C@H]2CC3=C([C@]1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)OC(=O)C5=CN=CC=C5
Structure:

CAS RN: 63870-11-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22ClNO
MOLECULAR WEIGHT: 267.79428
SMILES: CCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C.Cl
Structure:

CAS RN: 63870-10-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28ClNO
MOLECULAR WEIGHT: 357.91682
SMILES: CCC12CCN(C(C1)CC3=C2C=C(C=C3)O)CCC4=CC=CC=C4.Cl
Structure:

CAS RN: 63870-09-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28BrNO2
MOLECULAR WEIGHT: 418.36722
SMILES: C[C@@]12CCN([C@H]([C@H]1O)CC3=C2C=C(C=C3)OC)CCC4=CC=CC=C4.Br
Structure:

http://ChemLookup.com Compounds

2012-02-28T10:36:00.001-08:00

CAS RN: 63885-19-8
CAS Name: 1-[4-[3-(trifluoromethyl)phenyl]cyclohexyl]piperidine hydrochloride
OPENEYE Name: 1-[4-[3-(trifluoromethyl)phenyl]cyclohexyl]piperidine hydrochloride
IUPAC Name: 1-[4-[3-(trifluoromethyl)phenyl]cyclohexyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[4-[3-(trifluoromethyl)phenyl]cyclohexyl]piperidine hydrochloride
MOLECULAR FORMULA: C18H25ClF3N
MOLECULAR WEIGHT: 347.84601
SMILES: C1CCN(CC1)C2CCC(CC2)C3=CC(=CC=C3)C(F)(F)F.Cl
Structure:

CAS RN: 63885-18-7
CAS Name: 1-[4-(4-methylphenyl)cyclohexyl]piperidine hydrochloride
OPENEYE Name: 1-[4-(p-tolyl)cyclohexyl]piperidine hydrochloride
IUPAC Name: 1-[4-(4-methylphenyl)cyclohexyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[4-(4-methylphenyl)cyclohexyl]piperidine hydrochloride
MOLECULAR FORMULA: C18H28ClN
MOLECULAR WEIGHT: 293.87462
SMILES: CC1=CC=C(C=C1)C2CCC(CC2)N3CCCCC3.Cl
Structure:

CAS RN: 63885-17-6
CAS Name: 1-[4-(2-methylphenyl)cyclohexyl]piperidine hydrochloride
OPENEYE Name: 1-[4-(o-tolyl)cyclohexyl]piperidine hydrochloride
IUPAC Name: 1-[4-(2-methylphenyl)cyclohexyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[4-(2-methylphenyl)cyclohexyl]piperidine hydrochloride
MOLECULAR FORMULA: C18H28ClN
MOLECULAR WEIGHT: 293.87462
SMILES: CC1=CC=CC=C1C2CCC(CC2)N3CCCCC3.Cl
Structure:

CAS RN: 63885-16-5
CAS Name: 1-[4-(3-methylphenyl)cyclohexyl]piperidine hydrochloride
OPENEYE Name: 1-[4-(m-tolyl)cyclohexyl]piperidine hydrochloride
IUPAC Name: 1-[4-(3-methylphenyl)cyclohexyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[4-(3-methylphenyl)cyclohexyl]piperidine hydrochloride
MOLECULAR FORMULA: C18H28ClN
MOLECULAR WEIGHT: 293.87462
SMILES: CC1=CC=CC(=C1)C2CCC(CC2)N3CCCCC3.Cl
Structure:

CAS RN: 63885-15-4
CAS Name: 1-(6-methoxy-4-quinolinyl)-3-(3-propyl-4-piperidinyl)-1-propanol; nitric acid
OPENEYE Name: 1-(6-methoxy-4-quinolyl)-3-(3-propyl-4-piperidyl)propan-1-ol; nitric acid
IUPAC Name: 1-(6-methoxyquinolin-4-yl)-3-(3-propylpiperidin-4-yl)propan-1-ol; nitric acid
SYSTEMATIC NAME: 1-(6-methoxyquinolin-4-yl)-3-(3-propylpiperidin-4-yl)propan-1-ol; nitric acid
MOLECULAR FORMULA: C21H31N3O5
MOLECULAR WEIGHT: 405.48794
SMILES: CCCC1CNCCC1CCC(C2=C3C=C(C=CC3=NC=C2)OC)O.[N+](=O)(O)[O-]
Structure:

CAS RN: 63885-13-2
CAS Name: 2,2,4,6,6-pentamethylpiperidine
OPENEYE Name: 2,2,4,6,6-pentamethylpiperidine
IUPAC Name: 2,2,4,6,6-pentamethylpiperidine
SYSTEMATIC NAME: 2,2,4,6,6-pentamethylpiperidine
MOLECULAR FORMULA: C10H21N
MOLECULAR WEIGHT: 155.28044
SMILES: CC1CC(NC(C1)(C)C)(C)C
Structure:

CAS RN: 63885-12-1
CAS Name: 2-methyl-1-(3-phenoxypropyl)piperidine
OPENEYE Name: 2-methyl-1-(3-phenoxypropyl)piperidine
IUPAC Name: 2-methyl-1-(3-phenoxypropyl)piperidine
SYSTEMATIC NAME: 2-methyl-1-(3-phenoxypropyl)piperidine
MOLECULAR FORMULA: C15H23NO
MOLECULAR WEIGHT: 233.34922
SMILES: CC1CCCCN1CCCOC2=CC=CC=C2
Structure:

CAS RN: 63885-11-0
CAS Name: 1-[4-methoxy-4-(3-methylphenyl)cyclohexyl]piperidine
OPENEYE Name: 1-[4-methoxy-4-(m-tolyl)cyclohexyl]piperidine
IUPAC Name: 1-[4-methoxy-4-(3-methylphenyl)cyclohexyl]piperidine
SYSTEMATIC NAME: 1-[4-methoxy-4-(3-methylphenyl)cyclohexyl]piperidine
MOLECULAR FORMULA: C19H29NO
MOLECULAR WEIGHT: 287.43966
SMILES: CC1=CC=CC(=C1)C2(CCC(CC2)N3CCCCC3)OC
Structure:

CAS RN: 63885-02-9
CAS Name: zinc 2,3,5-trichlorobenzenethiolate
OPENEYE Name: zinc 2,3,5-trichlorobenzenethiolate
IUPAC Name: zinc 2,3,5-trichlorobenzenethiolate
SYSTEMATIC NAME: zinc 2,3,5-tris(chloranyl)benzenethiolate
MOLECULAR FORMULA: C12H4Cl6S2Zn
MOLECULAR WEIGHT: 490.41716
SMILES: C1=C(C=C(C(=C1Cl)Cl)[S-])Cl.C1=C(C=C(C(=C1Cl)Cl)[S-])Cl.[Zn+2]
Structure:

CAS RN: 63885-00-7
CAS Name: 1-methyl-1-[[4-[(1-methyl-1-pyrrolidin-1-iumyl)methyl]phenyl]methyl]pyrrolidin-1-ium dibromide
OPENEYE Name: 1-methyl-1-[[4-[(1-methylpyrrolidin-1-ium-1-yl)methyl]phenyl]methyl]pyrrolidin-1-ium dibromide
IUPAC Name: 1-methyl-1-[[4-[(1-methylpyrrolidin-1-ium-1-yl)methyl]phenyl]methyl]pyrrolidin-1-ium dibromide
SYSTEMATIC NAME: 1-methyl-1-[[4-[(1-methylpyrrolidin-1-ium-1-yl)methyl]phenyl]methyl]pyrrolidin-1-ium dibromide
MOLECULAR FORMULA: C18H30Br2N2
MOLECULAR WEIGHT: 434.2522
SMILES: C[N+]1(CCCC1)CC2=CC=C(C=C2)C[N+]3(CCCC3)C.[Br-].[Br-]
Structure:

CAS RN: 63884-68-4
CAS Name: N,N-dimethylcarbamic acid [4-(dimethylamino)-2-methyl-5-propan-2-ylphenyl] ester hydrochloride
OPENEYE Name: [4-(dimethylamino)-5-isopropyl-2-methyl-phenyl] N,N-dimethylcarbamate hydrochloride
IUPAC Name: [4-(dimethylamino)-2-methyl-5-propan-2-ylphenyl] N,N-dimethylcarbamate hydrochloride
SYSTEMATIC NAME: [4-(dimethylamino)-2-methyl-5-propan-2-yl-phenyl] N,N-dimethylcarbamate hydrochloride
MOLECULAR FORMULA: C15H25ClN2O2
MOLECULAR WEIGHT: 300.8242
SMILES: CC1=CC(=C(C=C1OC(=O)N(C)C)C(C)C)N(C)C.Cl
Structure:

CAS RN: 63884-57-1
CAS Name: 2-[amino-[(3-chlorophenyl)methyl]amino]-N-methylethanamine dihydrochloride
OPENEYE Name: 2-[amino-[(3-chlorophenyl)methyl]amino]-N-methyl-ethanamine dihydrochloride
IUPAC Name: 2-[amino-[(3-chlorophenyl)methyl]amino]-N-methylethanamine dihydrochloride
SYSTEMATIC NAME: 2-[azanyl-[(3-chlorophenyl)methyl]amino]-N-methyl-ethanamine dihydrochloride
MOLECULAR FORMULA: C10H18Cl3N3
MOLECULAR WEIGHT: 286.62902
SMILES: CNCCN(CC1=CC(=CC=C1)Cl)N.Cl.Cl
Structure:

CAS RN: 63884-55-9
CAS Name: 1-phenyl-N-(pyridin-4-ylmethylamino)methanesulfenamide
OPENEYE Name: 1-benzylsulfanyl-2-(4-pyridylmethyl)hydrazine
IUPAC Name: 1-benzylsulfanyl-2-(pyridin-4-ylmethyl)hydrazine
SYSTEMATIC NAME: 1-(phenylmethylsulfanyl)-2-(pyridin-4-ylmethyl)diazane
MOLECULAR FORMULA: C13H15N3S
MOLECULAR WEIGHT: 245.3433
SMILES: C1=CC=C(C=C1)CSNNCC2=CC=NC=C2
Structure:

CAS RN: 63884-54-8
CAS Name: (2R)-2,4-dihydroxy-3,3-dimethyl-N'-(phenylmethyl)butanehydrazide
OPENEYE Name: (2R)-N'-benzyl-2,4-dihydroxy-3,3-dimethyl-butanehydrazide
IUPAC Name: (2R)-N'-benzyl-2,4-dihydroxy-3,3-dimethylbutanehydrazide
SYSTEMATIC NAME: (2R)-3,3-dimethyl-2,4-bis(oxidanyl)-N'-(phenylmethyl)butanehydrazide
MOLECULAR FORMULA: C13H20N2O3
MOLECULAR WEIGHT: 252.3095
SMILES: CC(C)(CO)[C@H](C(=O)NNCC1=CC=CC=C1)O
Structure:

CAS RN: 63884-52-6
CAS Name: 2-[amino-(phenylmethyl)amino]-N-methylethanamine dihydrochloride
OPENEYE Name: 2-[amino(benzyl)amino]-N-methyl-ethanamine dihydrochloride
IUPAC Name: 2-[amino(benzyl)amino]-N-methylethanamine dihydrochloride
SYSTEMATIC NAME: 2-[azanyl-(phenylmethyl)amino]-N-methyl-ethanamine dihydrochloride
MOLECULAR FORMULA: C10H19Cl2N3
MOLECULAR WEIGHT: 252.18396
SMILES: CNCCN(CC1=CC=CC=C1)N.Cl.Cl
Structure:

CAS RN: 63884-44-6
CAS Name: 6-amino-5-(hydroxyamino)-1,3-dimethyl-1,3-diazinane-2,4-dione
OPENEYE Name: 6-amino-5-(hydroxyamino)-1,3-dimethyl-hexahydropyrimidine-2,4-dione
IUPAC Name: 6-amino-5-(hydroxyamino)-1,3-dimethyl-1,3-diazinane-2,4-dione
SYSTEMATIC NAME: 6-azanyl-1,3-dimethyl-5-(oxidanylamino)-1,3-diazinane-2,4-dione
MOLECULAR FORMULA: C6H12N4O3
MOLECULAR WEIGHT: 188.18448
SMILES: CN1C(C(C(=O)N(C1=O)C)NO)N
Structure:

CAS RN: 63884-43-5
CAS Name: 2,3,5-tribromo-6-methylbenzene-1,4-diol
OPENEYE Name: 2,3,5-tribromo-6-methyl-benzene-1,4-diol
IUPAC Name: 2,3,5-tribromo-6-methylbenzene-1,4-diol
SYSTEMATIC NAME: 2,3,5-tris(bromanyl)-6-methyl-benzene-1,4-diol
MOLECULAR FORMULA: C7H5Br3O2
MOLECULAR WEIGHT: 360.8254
SMILES: CC1=C(C(=C(C(=C1Br)O)Br)Br)O
Structure:

CAS RN: 63884-42-4
CAS Name: 2-[bis(2-chloroethyl)amino]-5-methoxybenzene-1,4-diol
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-5-methoxy-benzene-1,4-diol
IUPAC Name: 2-[bis(2-chloroethyl)amino]-5-methoxybenzene-1,4-diol
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-5-methoxy-benzene-1,4-diol
MOLECULAR FORMULA: C11H15Cl2NO3
MOLECULAR WEIGHT: 280.1477
SMILES: COC1=C(C=C(C(=C1)O)N(CCCl)CCCl)O
Structure:

CAS RN: 63884-33-3
CAS Name: 3-butyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol hydrochloride
OPENEYE Name: 3-butyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol hydrochloride
IUPAC Name: 3-butyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol hydrochloride
SYSTEMATIC NAME: 3-butyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol hydrochloride
MOLECULAR FORMULA: C19H30ClNO3
MOLECULAR WEIGHT: 355.8994
SMILES: CCCCC1CN2CCC3=CC(=C(C=C3C2CC1O)OC)OC.Cl
Structure:

CAS RN: 63884-31-1
CAS Name: 1,1-dimethyl-4-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethyl]piperidin-1-ium diiodide
OPENEYE Name: 1,1-dimethyl-4-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
IUPAC Name: 1,1-dimethyl-4-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1,1-dimethyl-4-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C14H30I2N2
MOLECULAR WEIGHT: 480.21034
SMILES: C[N+]1(CCC(CC1)CC[N+]2(CCCC2)C)C.[I-].[I-]
Structure:

http://ChemLookup.com Compounds

2012-02-28T09:36:00.001-08:00

CAS RN: 63885-84-7
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid (1-methyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-methyl-4-piperidyl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: (1-methylpiperidin-4-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C18H20ClN3O2S
MOLECULAR WEIGHT: 377.8883
SMILES: CN1CCC(CC1)OC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-83-6
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(2-methyl-1-piperidinyl)propyl ester hydrochloride
OPENEYE Name: 3-(2-methyl-1-piperidyl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-(2-methylpiperidin-1-yl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-(2-methylpiperidin-1-yl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C21H26ClN3O2S
MOLECULAR WEIGHT: 419.96804
SMILES: CC1CCCCN1CCCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-82-5
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(4-methyl-1-piperazinyl)propyl ester
OPENEYE Name: 3-(4-methylpiperazin-1-yl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
IUPAC Name: 3-(4-methylpiperazin-1-yl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
SYSTEMATIC NAME: 3-(4-methylpiperazin-1-yl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
MOLECULAR FORMULA: C20H24N4O2S
MOLECULAR WEIGHT: 384.49516
SMILES: CN1CCN(CC1)CCCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4
Structure:

CAS RN: 63885-81-4
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(4-methyl-1-piperazinyl)ethyl ester
OPENEYE Name: 2-(4-methylpiperazin-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
IUPAC Name: 2-(4-methylpiperazin-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
SYSTEMATIC NAME: 2-(4-methylpiperazin-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
MOLECULAR FORMULA: C19H22N4O2S
MOLECULAR WEIGHT: 370.46858
SMILES: CN1CCN(CC1)CCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4
Structure:

CAS RN: 63885-80-3
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid (1-ethyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-ethyl-4-piperidyl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: (1-ethylpiperidin-4-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: (1-ethylpiperidin-4-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C19H22ClN3O2S
MOLECULAR WEIGHT: 391.91488
SMILES: CCN1CCC(CC1)OC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-79-0
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(dipropylamino)propyl ester hydrochloride
OPENEYE Name: 3-(dipropylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-(dipropylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-(dipropylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C21H28ClN3O2S
MOLECULAR WEIGHT: 421.98392
SMILES: CCCN(CCC)CCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-78-9
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(dipropylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(dipropylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-(dipropylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-(dipropylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C20H26ClN3O2S
MOLECULAR WEIGHT: 407.95734
SMILES: CCCN(CCC)CCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-77-8
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(dimethylamino)propyl ester hydrochloride
OPENEYE Name: 3-(dimethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-(dimethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-(dimethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C17H20ClN3O2S
MOLECULAR WEIGHT: 365.8776
SMILES: CN(C)CCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-76-7
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(dimethylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(dimethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-(dimethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-(dimethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C16H18ClN3O2S
MOLECULAR WEIGHT: 351.85102
SMILES: CN(C)CCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-75-6
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-[di(propan-2-yl)amino]propyl ester hydrochloride
OPENEYE Name: 3-(diisopropylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-[di(propan-2-yl)amino]propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-[di(propan-2-yl)amino]propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C21H28ClN3O2S
MOLECULAR WEIGHT: 421.98392
SMILES: CC(C)N(CCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63885-74-5
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 1-[di(propan-2-yl)amino]propan-2-yl ester hydrochloride
OPENEYE Name: [2-(diisopropylamino)-1-methyl-ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 1-[di(propan-2-yl)amino]propan-2-yl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 1-[di(propan-2-yl)amino]propan-2-yl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C21H28ClN3O2S
MOLECULAR WEIGHT: 421.98392
SMILES: CC(C)N(CC(C)OC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63885-73-4
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-[2-[di(propan-2-yl)amino]ethylthio]ethyl ester hydrochloride
OPENEYE Name: 2-[2-(diisopropylamino)ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-[2-[di(propan-2-yl)amino]ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-[2-[di(propan-2-yl)amino]ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C22H30ClN3O2S2
MOLECULAR WEIGHT: 468.0755
SMILES: CC(C)N(CCSCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63885-72-3
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-[di(propan-2-yl)amino]ethyl ester hydrochloride
OPENEYE Name: 2-(diisopropylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-[di(propan-2-yl)amino]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-[di(propan-2-yl)amino]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C20H26ClN3O2S
MOLECULAR WEIGHT: 407.95734
SMILES: CC(C)N(CCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63885-71-2
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-[2-[di(propan-2-yl)amino]ethoxy]ethyl ester hydrochloride
OPENEYE Name: 2-[2-(diisopropylamino)ethoxy]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-[2-[di(propan-2-yl)amino]ethoxy]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-[2-[di(propan-2-yl)amino]ethoxy]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C22H30ClN3O3S
MOLECULAR WEIGHT: 452.0099
SMILES: CC(C)N(CCOCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63885-70-1
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(diethylamino)propyl ester hydrochloride
OPENEYE Name: 3-(diethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-(diethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-(diethylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C19H24ClN3O2S
MOLECULAR WEIGHT: 393.93076
SMILES: CCN(CC)CCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-45-0
CAS Name: triethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]ammonium dibromide
OPENEYE Name: triethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]ammonium dibromide
IUPAC Name: triethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]azanium dibromide
SYSTEMATIC NAME: triethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]azanium dibromide
MOLECULAR FORMULA: C21H31Br2N3
MOLECULAR WEIGHT: 485.29894
SMILES: CC[N+](CC)(CC)CCC[N+]1=C(C2=C(C=C1)C3=CC=CC=C3N2)C.[Br-].[Br-]
Structure:

CAS RN: 63885-41-6
CAS Name: 1-methyl-2-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
OPENEYE Name: 1-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
IUPAC Name: 1-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
SYSTEMATIC NAME: 1-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
MOLECULAR FORMULA: C20H27Br2N3
MOLECULAR WEIGHT: 469.25648
SMILES: CC1=[N+](C=CC2=C1N=C3C2C=CC=C3)CCC[N+]4(CCCC4)C.[Br-].[Br-]
Structure:

CAS RN: 63885-40-5
CAS Name: 1-methyl-2-[3-(1-methyl-1-piperidin-1-iumyl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
OPENEYE Name: 1-methyl-2-[3-(1-methylpiperidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
IUPAC Name: 1-methyl-2-[3-(1-methylpiperidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
SYSTEMATIC NAME: 1-methyl-2-[3-(1-methylpiperidin-1-ium-1-yl)propyl]-4bH-pyrido[3,4-b]indol-2-ium dibromide
MOLECULAR FORMULA: C21H29Br2N3
MOLECULAR WEIGHT: 483.28306
SMILES: CC1=[N+](C=CC2=C1N=C3C2C=CC=C3)CCC[N+]4(CCCCC4)C.[Br-].[Br-]
Structure:

CAS RN: 63885-39-2
CAS Name: 2-[6-(1,9-dimethyl-2-pyrido[3,4-b]indol-2-iumyl)hexyl]-1,9-dimethylpyrido[3,4-b]indol-2-ium dibromide
OPENEYE Name: 2-[6-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)hexyl]-1,9-dimethyl-pyrido[3,4-b]indol-2-ium dibromide
IUPAC Name: 2-[6-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)hexyl]-1,9-dimethylpyrido[3,4-b]indol-2-ium dibromide
SYSTEMATIC NAME: 2-[6-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)hexyl]-1,9-dimethyl-pyrido[3,4-b]indol-2-ium dibromide
MOLECULAR FORMULA: C32H36Br2N4
MOLECULAR WEIGHT: 636.46304
SMILES: CC1=[N+](C=CC2=C1N(C3=CC=CC=C23)C)CCCCCC[N+]4=C(C5=C(C=C4)C6=CC=CC=C6N5C)C.[Br-].[Br-]
Structure:

CAS RN: 63885-38-1
CAS Name: 1,9-dimethyl-2-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]pyrido[3,4-b]indol-2-ium dibromide
OPENEYE Name: 1,9-dimethyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,4-b]indol-2-ium dibromide
IUPAC Name: 1,9-dimethyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,4-b]indol-2-ium dibromide
SYSTEMATIC NAME: 1,9-dimethyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,4-b]indol-2-ium dibromide
MOLECULAR FORMULA: C21H29Br2N3
MOLECULAR WEIGHT: 483.28306
SMILES: CC1=[N+](C=CC2=C1N(C3=CC=CC=C23)C)CCC[N+]4(CCCC4)C.[Br-].[Br-]
Structure:

CAS RN: 63885-37-0
CAS Name: dimethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]-(phenylmethyl)ammonium dibromide
OPENEYE Name: benzyl-dimethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]ammonium dibromide
IUPAC Name: benzyl-dimethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]azanium dibromide
SYSTEMATIC NAME: dimethyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]-(phenylmethyl)azanium dibromide
MOLECULAR FORMULA: C24H29Br2N3
MOLECULAR WEIGHT: 519.31516
SMILES: CC1=[N+](C=CC2=C1NC3=CC=CC=C23)CCC[N+](C)(C)CC4=CC=CC=C4.[Br-].[Br-]
Structure:

CAS RN: 63885-34-7
CAS Name: trimethyl-[10-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)decyl]ammonium dibromide
OPENEYE Name: trimethyl-[10-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)decyl]ammonium dibromide
IUPAC Name: trimethyl-[10-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)decyl]azanium dibromide
SYSTEMATIC NAME: trimethyl-[10-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)decyl]azanium dibromide
MOLECULAR FORMULA: C25H39Br2N3
MOLECULAR WEIGHT: 541.40526
SMILES: CC1=[N+](C=CC2=C1NC3=CC=CC=C23)CCCCCCCCCC[N+](C)(C)C.[Br-].[Br-]
Structure:

CAS RN: 63885-33-6
CAS Name: diethyl-methyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]ammonium dibromide
OPENEYE Name: diethyl-methyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]ammonium dibromide
IUPAC Name: diethyl-methyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]azanium dibromide
SYSTEMATIC NAME: diethyl-methyl-[3-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)propyl]azanium dibromide
MOLECULAR FORMULA: C20H29Br2N3
MOLECULAR WEIGHT: 471.27236
SMILES: CC[N+](C)(CC)CCC[N+]1=C(C2=C(C=C1)C3=CC=CC=C3N2)C.[Br-].[Br-]
Structure:

CAS RN: 63885-32-5
CAS Name: 9-[2-(6-methyl-3-pyridinyl)ethyl]-3-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 9-[2-(6-methyl-3-pyridyl)ethyl]-3-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
IUPAC Name: 9-[2-(6-methylpyridin-3-yl)ethyl]-3-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 9-[2-(6-methylpyridin-3-yl)ethyl]-3-propyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C22H27N3
MOLECULAR WEIGHT: 333.46988
SMILES: CCCC1CC2=C(CN1)N(C3=CC=CC=C23)CCC4=CN=C(C=C4)C
Structure:

http://ChemLookup.com Compounds

2012-02-28T08:35:00.001-08:00

CAS RN: 63886-15-7
CAS Name: triethyl-[2-[2-(1-ethyl-1-pyrrolidin-1-iumyl)ethoxy]ethyl]ammonium dibromide
OPENEYE Name: triethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]ammonium dibromide
IUPAC Name: triethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]azanium dibromide
SYSTEMATIC NAME: triethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]azanium dibromide
MOLECULAR FORMULA: C16H36Br2N2O
MOLECULAR WEIGHT: 432.27784
SMILES: CC[N+]1(CCCC1)CCOCC[N+](CC)(CC)CC.[Br-].[Br-]
Structure:

CAS RN: 63886-14-6
CAS Name: triethyl-[6-(1-ethyl-5-methyl-2-pyrrolidinyl)hexyl]ammonium iodide hydroiodide
OPENEYE Name: triethyl-[6-(1-ethyl-5-methyl-pyrrolidin-2-yl)hexyl]ammonium iodide hydroiodide
IUPAC Name: triethyl-[6-(1-ethyl-5-methylpyrrolidin-2-yl)hexyl]azanium iodide hydroiodide
SYSTEMATIC NAME: triethyl-[6-(1-ethyl-5-methyl-pyrrolidin-2-yl)hexyl]azanium iodide hydroiodide
MOLECULAR FORMULA: C19H42I2N2
MOLECULAR WEIGHT: 552.35912
SMILES: CCN1C(CCC1CCCCCC[N+](CC)(CC)CC)C.I.[I-]
Structure:

CAS RN: 63886-13-5
CAS Name: ethyl-[2-[2-(1-ethyl-1-pyrrolidin-1-iumyl)ethoxy]ethyl]-dimethylammonium dibromide
OPENEYE Name: ethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]-dimethyl-ammonium dibromide
IUPAC Name: ethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]-dimethylazanium dibromide
SYSTEMATIC NAME: ethyl-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]-dimethyl-azanium dibromide
MOLECULAR FORMULA: C14H32Br2N2O
MOLECULAR WEIGHT: 404.22468
SMILES: CC[N+]1(CCCC1)CCOCC[N+](C)(C)CC.[Br-].[Br-]
Structure:

CAS RN: 63886-12-4
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-[2-(diethylamino)ethylthio]ethyl ester hydrochloride
OPENEYE Name: 2-[2-(diethylamino)ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-[2-(diethylamino)ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-[2-(diethylamino)ethylsulfanyl]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C20H26ClN3O2S2
MOLECULAR WEIGHT: 440.02234
SMILES: CCN(CC)CCSCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63886-11-3
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(diethylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(diethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-(diethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C18H22ClN3O2S
MOLECULAR WEIGHT: 379.90418
SMILES: CCN(CC)CCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63886-10-2
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(dibutylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(dibutylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-(dibutylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-(dibutylamino)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C22H30ClN3O2S
MOLECULAR WEIGHT: 436.0105
SMILES: CCCCN(CCCC)CCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63886-09-9
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-[bis(prop-2-enyl)amino]propyl ester hydrochloride
OPENEYE Name: 3-(diallylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-[bis(prop-2-enyl)amino]propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-[bis(prop-2-enyl)amino]propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C21H24ClN3O2S
MOLECULAR WEIGHT: 417.95216
SMILES: C=CCN(CCCOC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)CC=C.Cl
Structure:

CAS RN: 63886-08-8
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid [1-(phenylmethyl)-4-piperidinyl] ester hydrochloride
OPENEYE Name: (1-benzyl-4-piperidyl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: (1-benzylpiperidin-4-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: [1-(phenylmethyl)piperidin-4-yl] pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C24H24ClN3O2S
MOLECULAR WEIGHT: 453.98426
SMILES: C1CN(CCC1OC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4)CC5=CC=CC=C5.Cl
Structure:

CAS RN: 63886-07-7
CAS Name: N-[2-(1-piperazinyl)ethyl]-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-(2-piperazin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-(2-piperazin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-(2-piperazin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C18H22ClN5OS
MOLECULAR WEIGHT: 391.91818
SMILES: C1CN(CCN1)CCNC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63886-06-6
CAS Name: N-[3-(4-morpholinyl)propyl]-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-(3-morpholinopropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-(3-morpholin-4-ylpropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-(3-morpholin-4-ylpropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C19H23ClN4O2S
MOLECULAR WEIGHT: 406.92952
SMILES: C1COCCN1CCCNC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63886-05-5
CAS Name: N-(4-methyl-1-piperazinyl)-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C17H20ClN5OS
MOLECULAR WEIGHT: 377.8916
SMILES: CN1CCN(CC1)NC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63886-04-4
CAS Name: N-(3-methoxypropyl)-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide
OPENEYE Name: N-(3-methoxypropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
IUPAC Name: N-(3-methoxypropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
SYSTEMATIC NAME: N-(3-methoxypropyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
MOLECULAR FORMULA: C16H17N3O2S
MOLECULAR WEIGHT: 315.39008
SMILES: COCCCNC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3
Structure:

CAS RN: 63886-03-3
CAS Name: N-(2-hydroxyethyl)-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide
OPENEYE Name: N-(2-hydroxyethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
IUPAC Name: N-(2-hydroxyethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
MOLECULAR FORMULA: C14H13N3O2S
MOLECULAR WEIGHT: 287.33692
SMILES: C1=CC=C2C(=C1)N(C3=C(S2)C=CC=N3)C(=O)NCCO
Structure:

CAS RN: 63886-02-2
CAS Name: N-ethyl-N-(4-methyl-1-piperazinyl)-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-ethyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-ethyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-ethyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C19H24ClN5OS
MOLECULAR WEIGHT: 405.94476
SMILES: CCN(C(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)N4CCN(CC4)C.Cl
Structure:

CAS RN: 63886-01-1
CAS Name: N-[3-(dimethylamino)propyl]-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-[3-(dimethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-[3-(dimethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-[3-(dimethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C17H21ClN4OS
MOLECULAR WEIGHT: 364.89284
SMILES: CN(C)CCCNC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63886-00-0
CAS Name: N-[3-(diethylamino)propyl]-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-[3-(diethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-[3-(diethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-[3-(diethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C19H25ClN4OS
MOLECULAR WEIGHT: 392.946
SMILES: CCN(CC)CCCNC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-99-4
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-(1-pyrrolidinyl)propyl] ester hydrochloride
OPENEYE Name: S-(3-pyrrolidin-1-ylpropyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-(3-pyrrolidin-1-ylpropyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-(3-pyrrolidin-1-ylpropyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C19H22ClN3OS2
MOLECULAR WEIGHT: 407.98048
SMILES: C1CCN(C1)CCCSC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-98-3
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-(1-piperidinyl)propyl] ester hydrochloride
OPENEYE Name: S-[3-(1-piperidyl)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-(3-piperidin-1-ylpropyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-(3-piperidin-1-ylpropyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C20H24ClN3OS2
MOLECULAR WEIGHT: 422.00706
SMILES: C1CCN(CC1)CCCSC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-96-1
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-(dipropylamino)propyl] ester hydrochloride
OPENEYE Name: S-[3-(dipropylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[3-(dipropylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[3-(dipropylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C21H28ClN3OS2
MOLECULAR WEIGHT: 438.04952
SMILES: CCCN(CCC)CCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-95-0
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[2-(dipropylamino)ethyl] ester hydrochloride
OPENEYE Name: S-[2-(dipropylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[2-(dipropylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[2-(dipropylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C20H26ClN3OS2
MOLECULAR WEIGHT: 424.02294
SMILES: CCCN(CCC)CCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63885-94-9
CAS Name: 1-amino-3-(4-chlorophenyl)-2-pyrrolidinone
OPENEYE Name: 1-amino-3-(4-chlorophenyl)pyrrolidin-2-one
IUPAC Name: 1-amino-3-(4-chlorophenyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-azanyl-3-(4-chlorophenyl)pyrrolidin-2-one
MOLECULAR FORMULA: C10H11ClN2O
MOLECULAR WEIGHT: 210.66014
SMILES: C1CN(C(=O)C1C2=CC=C(C=C2)Cl)N
Structure:

CAS RN: 63885-93-8
CAS Name: (3R,5S)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-2-pyrrolidinone; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
OPENEYE Name: (3R,5S)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
IUPAC Name: (3R,5S)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
SYSTEMATIC NAME: (3R,5S)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
MOLECULAR FORMULA: C30H32N6O6
MOLECULAR WEIGHT: 572.61168
SMILES: C[C@H]1C[C@H](C(=O)N1C2=CC=CC=C2)N(C)CCC3=CC=CC=C3.CC1=NN(C(=O)C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 5301-32-6
CAS Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-2-pyrrolidinone; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
OPENEYE Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
IUPAC Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
SYSTEMATIC NAME: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
MOLECULAR FORMULA: C30H32N6O6
MOLECULAR WEIGHT: 572.61168
SMILES: C[C@@H]1C[C@H](C(=O)N1C2=CC=CC=C2)N(C)CCC3=CC=CC=C3.CC1=NN(C(=O)C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 63885-92-7
CAS Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-2-pyrrolidinone; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
OPENEYE Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
IUPAC Name: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
SYSTEMATIC NAME: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenyl-pyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
MOLECULAR FORMULA: C30H32N6O6
MOLECULAR WEIGHT: 572.61168
SMILES: C[C@@H]1C[C@H](C(=O)N1C2=CC=CC=C2)N(C)CCC3=CC=CC=C3.CC1=NN(C(=O)C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 63885-90-5
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(1-pyrrolidinyl)propyl ester hydrochloride
OPENEYE Name: 3-pyrrolidin-1-ylpropyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-pyrrolidin-1-ylpropyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-pyrrolidin-1-ylpropyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C19H22ClN3O2S
MOLECULAR WEIGHT: 391.91488
SMILES: C1CCN(C1)CCCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-89-2
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(1-pyrrolidinyl)ethyl ester hydrochloride
OPENEYE Name: 2-pyrrolidin-1-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-pyrrolidin-1-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-pyrrolidin-1-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C18H20ClN3O2S
MOLECULAR WEIGHT: 377.8883
SMILES: C1CCN(C1)CCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-88-1
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 3-(1-piperidinyl)propyl ester hydrochloride
OPENEYE Name: 3-(1-piperidyl)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 3-piperidin-1-ylpropyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 3-piperidin-1-ylpropyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C20H24ClN3O2S
MOLECULAR WEIGHT: 405.94146
SMILES: C1CCN(CC1)CCCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-87-0
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-[3-(1-piperidinyl)propoxy]ethyl ester hydrochloride
OPENEYE Name: 2-[3-(1-piperidyl)propoxy]ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-(3-piperidin-1-ylpropoxy)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-(3-piperidin-1-ylpropoxy)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C22H28ClN3O3S
MOLECULAR WEIGHT: 449.99402
SMILES: C1CCN(CC1)CCCOCCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-86-9
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(1-piperidinyl)ethyl ester hydrochloride
OPENEYE Name: 2-(1-piperidyl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-piperidin-1-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-piperidin-1-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C19H22ClN3O2S
MOLECULAR WEIGHT: 391.91488
SMILES: C1CCN(CC1)CCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63885-85-8
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid (1-methyl-3-piperidinyl) ester hydrochloride
OPENEYE Name: (1-methyl-3-piperidyl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: (1-methylpiperidin-3-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: (1-methylpiperidin-3-yl) pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C18H20ClN3O2S
MOLECULAR WEIGHT: 377.8883
SMILES: CN1CCCC(C1)OC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T07:36:00.001-08:00

CAS RN: 63886-36-2
CAS Name: 1-[5-methoxy-8-(1-pyrrolidinylsulfonyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine hydrochloride
OPENEYE Name: 1-(5-methoxy-8-pyrrolidin-1-ylsulfonyl-tetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(5-methoxy-8-pyrrolidin-1-ylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(5-methoxy-8-pyrrolidin-1-ylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C19H29ClN2O3S
MOLECULAR WEIGHT: 400.96316
SMILES: COC1=C2CCCC(C2=C(C=C1)S(=O)(=O)N3CCCC3)N4CCCC4.Cl
Structure:

CAS RN: 63886-35-1
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]-1-propanone
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)propan-1-one
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
MOLECULAR FORMULA: C18H25NO2
MOLECULAR WEIGHT: 287.3966
SMILES: CCC(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3
Structure:

CAS RN: 63886-34-0
CAS Name: 1-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(5-methoxytetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C15H22ClNO
MOLECULAR WEIGHT: 267.79428
SMILES: COC1=CC=CC2=C1CCCC2N3CCCC3.Cl
Structure:

CAS RN: 63886-33-9
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]-3-methyl-1-butanone hydrochloride
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)-3-methyl-butan-1-one hydrochloride
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)-3-methylbutan-1-one hydrochloride
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)-3-methyl-butan-1-one hydrochloride
MOLECULAR FORMULA: C20H30ClNO2
MOLECULAR WEIGHT: 351.9107
SMILES: CC(C)CC(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3.Cl
Structure:

CAS RN: 63886-32-8
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]-2-methyl-1-propanone hydrochloride
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)-2-methyl-propan-1-one hydrochloride
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)-2-methylpropan-1-one hydrochloride
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)-2-methyl-propan-1-one hydrochloride
MOLECULAR FORMULA: C19H28ClNO2
MOLECULAR WEIGHT: 337.88412
SMILES: CC(C)C(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3.Cl
Structure:

CAS RN: 63886-31-7
CAS Name: 1-(8-fluoro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(8-fluoro-5-methoxy-tetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(8-fluoro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(8-fluoranyl-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C15H21ClFNO
MOLECULAR WEIGHT: 285.784743
SMILES: COC1=C2CCCC(C2=C(C=C1)F)N3CCCC3.Cl
Structure:

CAS RN: 63886-30-6
CAS Name: 1-(7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(7,8-dimethoxytetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C16H24ClNO2
MOLECULAR WEIGHT: 297.82026
SMILES: COC1=C(C2=C(CCCC2N3CCCC3)C=C1)OC.Cl
Structure:

CAS RN: 63886-29-3
CAS Name: 1-(8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(8-chloro-5-methoxy-tetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(8-chloranyl-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C15H21Cl2NO
MOLECULAR WEIGHT: 302.23934
SMILES: COC1=C2CCCC(C2=C(C=C1)Cl)N3CCCC3.Cl
Structure:

CAS RN: 63886-28-2
CAS Name: 1-(5-chloro-7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(5-chloro-7,8-dimethoxy-tetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(5-chloro-7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(5-chloranyl-7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C16H23Cl2NO2
MOLECULAR WEIGHT: 332.26532
SMILES: COC1=CC(=C2CCCC(C2=C1OC)N3CCCC3)Cl.Cl
Structure:

CAS RN: 63886-27-1
CAS Name: 3-(4-methoxyphenyl)-1-(1-piperidinyl)-2-pyrrolidinone hydrochloride
OPENEYE Name: 3-(4-methoxyphenyl)-1-(1-piperidyl)pyrrolidin-2-one hydrochloride
IUPAC Name: 3-(4-methoxyphenyl)-1-piperidin-1-ylpyrrolidin-2-one hydrochloride
SYSTEMATIC NAME: 3-(4-methoxyphenyl)-1-piperidin-1-yl-pyrrolidin-2-one hydrochloride
MOLECULAR FORMULA: C16H23ClN2O2
MOLECULAR WEIGHT: 310.81902
SMILES: COC1=CC=C(C=C1)C2CCN(C2=O)N3CCCCC3.Cl
Structure:

CAS RN: 63886-26-0
CAS Name: 2-pyrrolidinone hydrochloride
OPENEYE Name: pyrrolidin-2-one hydrochloride
IUPAC Name: pyrrolidin-2-one hydrochloride
SYSTEMATIC NAME: pyrrolidin-2-one hydrochloride
MOLECULAR FORMULA: C4H8ClNO
MOLECULAR WEIGHT: 121.56542
SMILES: C1CC(=O)NC1.Cl
Structure:

CAS RN: 63886-25-9
CAS Name: 3-amino-1-phenyl-2-pyrrolidinone hydrate hydrochloride
OPENEYE Name: 3-amino-1-phenyl-pyrrolidin-2-one hydrate hydrochloride
IUPAC Name: 3-amino-1-phenylpyrrolidin-2-one hydrate hydrochloride
SYSTEMATIC NAME: 3-azanyl-1-phenyl-pyrrolidin-2-one hydrate hydrochloride
MOLECULAR FORMULA: C10H15ClN2O2
MOLECULAR WEIGHT: 230.6913
SMILES: C1CN(C(=O)C1N)C2=CC=CC=C2.O.Cl
Structure:

CAS RN: 63886-24-8
CAS Name: 1-methyl-1-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]pyrrolidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrrolidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrrolidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrrolidin-1-ium diiodide
MOLECULAR FORMULA: C13H28I2N2
MOLECULAR WEIGHT: 466.18376
SMILES: C[N+]1(CCCC1)CCC[N+]2(CCCC2)C.[I-].[I-]
Structure:

CAS RN: 63886-23-7
CAS Name: 1-methyl-1-[4-(1-methyl-1-pyrrolidin-1-iumyl)butyl]pyrrolidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]pyrrolidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]pyrrolidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]pyrrolidin-1-ium diiodide
MOLECULAR FORMULA: C14H30I2N2
MOLECULAR WEIGHT: 480.21034
SMILES: C[N+]1(CCCC1)CCCC[N+]2(CCCC2)C.[I-].[I-]
Structure:

CAS RN: 63886-22-6
CAS Name: 1-[1-[(sulfothio)methyl]cyclohexyl]pyrrolidine
OPENEYE Name: 1-[1-(sulfosulfanylmethyl)cyclohexyl]pyrrolidine
IUPAC Name: 1-[1-(sulfosulfanylmethyl)cyclohexyl]pyrrolidine
SYSTEMATIC NAME: 1-[1-(sulfosulfanylmethyl)cyclohexyl]pyrrolidine
MOLECULAR FORMULA: C11H21NO3S2
MOLECULAR WEIGHT: 279.41934
SMILES: C1CCC(CC1)(CSS(=O)(=O)O)N2CCCC2
Structure:

CAS RN: 63886-21-5
CAS Name: 1-methyl-1-[2-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethoxy]ethyl]pyrrolidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium diiodide
MOLECULAR FORMULA: C14H30I2N2O
MOLECULAR WEIGHT: 496.20974
SMILES: C[N+]1(CCCC1)CCOCC[N+]2(CCCC2)C.[I-].[I-]
Structure:

CAS RN: 63886-20-4
CAS Name: 1-ethyl-1-[2-[2-(1-ethyl-1-pyrrolidin-1-iumyl)ethoxy]ethyl]pyrrolidin-1-ium dibromide
OPENEYE Name: 1-ethyl-1-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium dibromide
IUPAC Name: 1-ethyl-1-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium dibromide
SYSTEMATIC NAME: 1-ethyl-1-[2-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium dibromide
MOLECULAR FORMULA: C16H34Br2N2O
MOLECULAR WEIGHT: 430.26196
SMILES: CC[N+]1(CCCC1)CCOCC[N+]2(CCCC2)CC.[Br-].[Br-]
Structure:

CAS RN: 63886-19-1
CAS Name: trimethyl-[2-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethoxy]ethyl]ammonium diiodide
OPENEYE Name: trimethyl-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]ammonium diiodide
IUPAC Name: trimethyl-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
SYSTEMATIC NAME: trimethyl-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
MOLECULAR FORMULA: C12H28I2N2O
MOLECULAR WEIGHT: 470.17246
SMILES: C[N+]1(CCCC1)CCOCC[N+](C)(C)C.[I-].[I-]
Structure:

CAS RN: 63886-17-9
CAS Name: 1-ethyl-1-[6-(1-ethyl-1-pyrrolidin-1-iumyl)hexyl]pyrrolidin-1-ium dibromide
OPENEYE Name: 1-ethyl-1-[6-(1-ethylpyrrolidin-1-ium-1-yl)hexyl]pyrrolidin-1-ium dibromide
IUPAC Name: 1-ethyl-1-[6-(1-ethylpyrrolidin-1-ium-1-yl)hexyl]pyrrolidin-1-ium dibromide
SYSTEMATIC NAME: 1-ethyl-1-[6-(1-ethylpyrrolidin-1-ium-1-yl)hexyl]pyrrolidin-1-ium dibromide
MOLECULAR FORMULA: C18H38Br2N2
MOLECULAR WEIGHT: 442.31572
SMILES: CC[N+]1(CCCC1)CCCCCC[N+]2(CCCC2)CC.[Br-].[Br-]
Structure:

CAS RN: 63886-16-8
CAS Name: 2-[6-(1,2-dimethyl-1-pyrrolidin-1-iumyl)hexyl]-1,5-dimethylpyrrolidine iodide hydroiodide
OPENEYE Name: 2-[6-(1,2-dimethylpyrrolidin-1-ium-1-yl)hexyl]-1,5-dimethyl-pyrrolidine iodide hydroiodide
IUPAC Name: 2-[6-(1,2-dimethylpyrrolidin-1-ium-1-yl)hexyl]-1,5-dimethylpyrrolidine iodide hydroiodide
SYSTEMATIC NAME: 2-[6-(1,2-dimethylpyrrolidin-1-ium-1-yl)hexyl]-1,5-dimethyl-pyrrolidine iodide hydroiodide
MOLECULAR FORMULA: C18H38I2N2
MOLECULAR WEIGHT: 536.31666
SMILES: CC1CCC(N1C)CCCCCC[N+]2(CCCC2C)C.I.[I-]
Structure:

http://ChemLookup.com Compounds

2012-02-28T06:35:00.001-08:00

CAS RN: 63886-56-6
CAS Name: 2-(3,4-dimethyl-1-pyrrolidinyl)ethanol
OPENEYE Name: 2-(3,4-dimethylpyrrolidin-1-yl)ethanol
IUPAC Name: 2-(3,4-dimethylpyrrolidin-1-yl)ethanol
SYSTEMATIC NAME: 2-(3,4-dimethylpyrrolidin-1-yl)ethanol
MOLECULAR FORMULA: C8H17NO
MOLECULAR WEIGHT: 143.22668
SMILES: CC1CN(CC1C)CCO
Structure:

CAS RN: 63886-55-5
CAS Name: N-[(4-chlorophenyl)-(2,2-dichloroethenoxy)phosphoryl]-N-methylmethanamine
OPENEYE Name: N-[(4-chlorophenyl)-(2,2-dichlorovinyloxy)phosphoryl]-N-methyl-methanamine
IUPAC Name: N-[(4-chlorophenyl)-(2,2-dichloroethenoxy)phosphoryl]-N-methylmethanamine
SYSTEMATIC NAME: N-[2,2-bis(chloranyl)ethenoxy-(4-chlorophenyl)phosphoryl]-N-methyl-methanamine
MOLECULAR FORMULA: C10H11Cl3NO2P
MOLECULAR WEIGHT: 314.532601
SMILES: CN(C)P(=O)(C1=CC=C(C=C1)Cl)OC=C(Cl)Cl
Structure:

CAS RN: 63886-52-2
CAS Name: [butyl(prop-2-enoxy)phosphoryl]benzene
OPENEYE Name: [allyloxy(butyl)phosphoryl]benzene
IUPAC Name: [butyl(prop-2-enoxy)phosphoryl]benzene
SYSTEMATIC NAME: [butyl(prop-2-enoxy)phosphoryl]benzene
MOLECULAR FORMULA: C13H19O2P
MOLECULAR WEIGHT: 238.262521
SMILES: CCCCP(=O)(C1=CC=CC=C1)OCC=C
Structure:

CAS RN: 63886-49-7
CAS Name: 2-[2-(1,2-dimethyl-1-pyrrolidin-1-iumyl)ethyl]-1,5-dimethylpyrrolidine iodide hydroiodide
OPENEYE Name: 2-[2-(1,2-dimethylpyrrolidin-1-ium-1-yl)ethyl]-1,5-dimethyl-pyrrolidine iodide hydroiodide
IUPAC Name: 2-[2-(1,2-dimethylpyrrolidin-1-ium-1-yl)ethyl]-1,5-dimethylpyrrolidine iodide hydroiodide
SYSTEMATIC NAME: 2-[2-(1,2-dimethylpyrrolidin-1-ium-1-yl)ethyl]-1,5-dimethyl-pyrrolidine iodide hydroiodide
MOLECULAR FORMULA: C14H30I2N2
MOLECULAR WEIGHT: 480.21034
SMILES: CC1CCC(N1C)CC[N+]2(CCCC2C)C.I.[I-]
Structure:

CAS RN: 63886-48-6
CAS Name: 1-methyl-1-[12-(1-methyl-1-pyrrolidin-1-iumyl)dodecyl]pyrrolidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[12-(1-methylpyrrolidin-1-ium-1-yl)dodecyl]pyrrolidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[12-(1-methylpyrrolidin-1-ium-1-yl)dodecyl]pyrrolidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[12-(1-methylpyrrolidin-1-ium-1-yl)dodecyl]pyrrolidin-1-ium diiodide
MOLECULAR FORMULA: C22H46I2N2
MOLECULAR WEIGHT: 592.42298
SMILES: C[N+]1(CCCC1)CCCCCCCCCCCC[N+]2(CCCC2)C.[I-].[I-]
Structure:

CAS RN: 63886-47-5
CAS Name: 6-(1,5-dimethyl-2-pyrrolidinyl)hexyl-trimethylammonium iodide hydroiodide
OPENEYE Name: 6-(1,5-dimethylpyrrolidin-2-yl)hexyl-trimethyl-ammonium iodide hydroiodide
IUPAC Name: 6-(1,5-dimethylpyrrolidin-2-yl)hexyl-trimethylazanium iodide hydroiodide
SYSTEMATIC NAME: 6-(1,5-dimethylpyrrolidin-2-yl)hexyl-trimethyl-azanium iodide hydroiodide
MOLECULAR FORMULA: C15H34I2N2
MOLECULAR WEIGHT: 496.2528
SMILES: CC1CCC(N1C)CCCCCC[N+](C)(C)C.I.[I-]
Structure:

CAS RN: 63886-46-4
CAS Name: 2-(1,5-dimethyl-2-pyrrolidinyl)ethyl-trimethylammonium iodide hydroiodide
OPENEYE Name: 2-(1,5-dimethylpyrrolidin-2-yl)ethyl-trimethyl-ammonium iodide hydroiodide
IUPAC Name: 2-(1,5-dimethylpyrrolidin-2-yl)ethyl-trimethylazanium iodide hydroiodide
SYSTEMATIC NAME: 2-(1,5-dimethylpyrrolidin-2-yl)ethyl-trimethyl-azanium iodide hydroiodide
MOLECULAR FORMULA: C11H26I2N2
MOLECULAR WEIGHT: 440.14648
SMILES: CC1CCC(N1C)CC[N+](C)(C)C.I.[I-]
Structure:

CAS RN: 63886-44-2
CAS Name: 1-methyl-1-[10-(1-methyl-1-pyrrolidin-1-iumyl)decyl]pyrrolidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[10-(1-methylpyrrolidin-1-ium-1-yl)decyl]pyrrolidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[10-(1-methylpyrrolidin-1-ium-1-yl)decyl]pyrrolidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[10-(1-methylpyrrolidin-1-ium-1-yl)decyl]pyrrolidin-1-ium diiodide
MOLECULAR FORMULA: C20H42I2N2
MOLECULAR WEIGHT: 564.36982
SMILES: C[N+]1(CCCC1)CCCCCCCCCC[N+]2(CCCC2)C.[I-].[I-]
Structure:

CAS RN: 63886-43-1
CAS Name: 3-[1-[2-(2-butoxyethoxy)ethyl]-1-methyl-2-pyrrolidin-1-iumyl]pyridine; 4-methylbenzenesulfonic acid
OPENEYE Name: 3-[1-[2-(2-butoxyethoxy)ethyl]-1-methyl-pyrrolidin-1-ium-2-yl]pyridine; 4-methylbenzenesulfonic acid
IUPAC Name: 3-[1-[2-(2-butoxyethoxy)ethyl]-1-methylpyrrolidin-1-ium-2-yl]pyridine; 4-methylbenzenesulfonic acid
SYSTEMATIC NAME: 3-[1-[2-(2-butoxyethoxy)ethyl]-1-methyl-pyrrolidin-1-ium-2-yl]pyridine; 4-methylbenzenesulfonic acid
MOLECULAR FORMULA: C25H39N2O5S+
MOLECULAR WEIGHT: 479.65256
SMILES: CCCCOCCOCC[N+]1(CCCC1C2=CN=CC=C2)C.CC1=CC=C(C=C1)S(=O)(=O)O
Structure:

CAS RN: 63886-41-9
CAS Name: 3-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]-3-azabicyclo[3.3.1]nonane iodide
OPENEYE Name: 3-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-3-azabicyclo[3.3.1]nonane iodide
IUPAC Name: 3-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-3-azabicyclo[3.3.1]nonane iodide
SYSTEMATIC NAME: 3-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-3-azabicyclo[3.3.1]nonane iodide
MOLECULAR FORMULA: C16H31IN2
MOLECULAR WEIGHT: 378.33521
SMILES: C[N+]1(CCCC1)CCCN2CC3CCCC(C3)C2.[I-]
Structure:

CAS RN: 63886-40-8
CAS Name: 3-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethyl]-3-azabicyclo[3.3.1]nonane iodide
OPENEYE Name: 3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane iodide
IUPAC Name: 3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane iodide
SYSTEMATIC NAME: 3-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]-3-azabicyclo[3.3.1]nonane iodide
MOLECULAR FORMULA: C15H29IN2
MOLECULAR WEIGHT: 364.30863
SMILES: C[N+]1(CCCC1)CCN2CC3CCCC(C3)C2.[I-]
Structure:

CAS RN: 63886-39-5
CAS Name: 3-[4-(1-methyl-1-pyrrolidin-1-iumyl)butyl]-3-azabicyclo[3.3.1]nonane iodide
OPENEYE Name: 3-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]-3-azabicyclo[3.3.1]nonane iodide
IUPAC Name: 3-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]-3-azabicyclo[3.3.1]nonane iodide
SYSTEMATIC NAME: 3-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]-3-azabicyclo[3.3.1]nonane iodide
MOLECULAR FORMULA: C17H33IN2
MOLECULAR WEIGHT: 392.36179
SMILES: C[N+]1(CCCC1)CCCCN2CC3CCCC(C3)C2.[I-]
Structure:

CAS RN: 63886-37-3
CAS Name: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-tetralin-1-ylpyrrolidine hydrochloride
IUPAC Name: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C14H20ClN
MOLECULAR WEIGHT: 237.7683
SMILES: C1CCN(C1)C2CCCC3=CC=CC=C23.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T05:36:00.001-08:00

CAS RN: 63903-55-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrNO2
MOLECULAR WEIGHT: 328.24468
SMILES: C[C@@]12CCN([C@H]([C@]1(C)O)CC3=C2C=C(C=C3)O)C.Br
Structure:

CAS RN: 63903-54-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22ClNO2
MOLECULAR WEIGHT: 283.79368
SMILES: CC[C@@]12CCN([C@H]([C@H]1O)CC3=C2C=C(C=C3)O)C.Cl
Structure:

CAS RN: 63903-53-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24BrNO2
MOLECULAR WEIGHT: 342.27126
SMILES: CC[C@@]12CCN([C@H]([C@]1(C)O)CC3=C2C=C(C=C3)O)C.Br
Structure:

CAS RN: 63903-50-4
CAS Name: hexacopper (2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate
OPENEYE Name: hexacopper (2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate
IUPAC Name: hexacopper (2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate
SYSTEMATIC NAME: hexacopper (2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate
MOLECULAR FORMULA: C6H6Cu6O24P6
MOLECULAR WEIGHT: 1029.216006
SMILES: C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2].[Cu+2].[Cu+2]
Structure:

CAS RN: 63903-01-5
CAS Name: (S)-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-(3-pyridinyl)methanol hydrochloride
OPENEYE Name: (S)-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-(3-pyridyl)methanol hydrochloride
IUPAC Name: (S)-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-pyridin-3-ylmethanol hydrochloride
SYSTEMATIC NAME: (S)-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-pyridin-3-yl-methanol hydrochloride
MOLECULAR FORMULA: C16H18ClNO2
MOLECULAR WEIGHT: 291.77262
SMILES: COC1=CC=C(C=C1)[C@H]2C[C@@H]2[C@@H](C3=CN=CC=C3)O.Cl
Structure:

CAS RN: 63903-00-4
CAS Name: (S)-[(1S,2S)-2-(4-methylphenyl)cyclopropyl]-(3-pyridinyl)methanol hydrochloride
OPENEYE Name: (S)-[(1S,2S)-2-(p-tolyl)cyclopropyl]-(3-pyridyl)methanol hydrochloride
IUPAC Name: (S)-[(1S,2S)-2-(4-methylphenyl)cyclopropyl]-pyridin-3-ylmethanol hydrochloride
SYSTEMATIC NAME: (S)-[(1S,2S)-2-(4-methylphenyl)cyclopropyl]-pyridin-3-yl-methanol hydrochloride
MOLECULAR FORMULA: C16H18ClNO
MOLECULAR WEIGHT: 275.77322
SMILES: CC1=CC=C(C=C1)[C@H]2C[C@@H]2[C@@H](C3=CN=CC=C3)O.Cl
Structure:

CAS RN: 63903-03-7
CAS Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-(3-pyridinyl)methanol
OPENEYE Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-(3-pyridyl)methanol
IUPAC Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-pyridin-3-ylmethanol
SYSTEMATIC NAME: (S)-[(1S,2S)-2-phenylcyclopropyl]-pyridin-3-yl-methanol
MOLECULAR FORMULA: C15H15NO
MOLECULAR WEIGHT: 225.2857
SMILES: C1[C@@H]([C@H]1[C@@H](C2=CN=CC=C2)O)C3=CC=CC=C3
Structure:

CAS RN: 63902-99-8
CAS Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-(3-pyridinyl)methanol hydrochloride
OPENEYE Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-(3-pyridyl)methanol hydrochloride
IUPAC Name: (S)-[(1S,2S)-2-phenylcyclopropyl]-pyridin-3-ylmethanol hydrochloride
SYSTEMATIC NAME: (S)-[(1S,2S)-2-phenylcyclopropyl]-pyridin-3-yl-methanol hydrochloride
MOLECULAR FORMULA: C15H16ClNO
MOLECULAR WEIGHT: 261.74664
SMILES: C1[C@@H]([C@H]1[C@@H](C2=CN=CC=C2)O)C3=CC=CC=C3.Cl
Structure:

CAS RN: 63901-49-5
CAS Name: 5-(ethenylthio)-1H-1,2,4-triazole
OPENEYE Name: 5-vinylsulfanyl-1H-1,2,4-triazole
IUPAC Name: 5-ethenylsulfanyl-1H-1,2,4-triazole
SYSTEMATIC NAME: 5-ethenylsulfanyl-1H-1,2,4-triazole
MOLECULAR FORMULA: C4H5N3S
MOLECULAR WEIGHT: 127.1676
SMILES: C=CSC1=NC=NN1
Structure:

CAS RN: 63901-43-9
CAS Name: 4-hydrazinyl-2-methyl-5-methylsulfonyl-3-pyridazinone
OPENEYE Name: 4-hydrazino-2-methyl-5-methylsulfonyl-pyridazin-3-one
IUPAC Name: 4-hydrazinyl-2-methyl-5-methylsulfonylpyridazin-3-one
SYSTEMATIC NAME: 4-diazanyl-2-methyl-5-methylsulfonyl-pyridazin-3-one
MOLECULAR FORMULA: C6H10N4O3S
MOLECULAR WEIGHT: 218.2336
SMILES: CN1C(=O)C(=C(C=N1)S(=O)(=O)C)NN
Structure:

CAS RN: 63887-46-7
CAS Name: 1-[5-(4-hydroxy-1-piperidin-1-iumylidene)-1-cyclopenta-1,3-dienyl]-4-piperidinol chloride dihydrate
OPENEYE Name: 1-[5-(4-hydroxypiperidin-1-ium-1-ylidene)cyclopenta-1,3-dien-1-yl]piperidin-4-ol chloride dihydrate
IUPAC Name: 1-[5-(4-hydroxypiperidin-1-ium-1-ylidene)cyclopenta-1,3-dien-1-yl]piperidin-4-ol chloride dihydrate
SYSTEMATIC NAME: 1-[5-(4-oxidanylpiperidin-1-ium-1-ylidene)cyclopenta-1,3-dien-1-yl]piperidin-4-ol chloride dihydrate
MOLECULAR FORMULA: C15H27ClN2O4
MOLECULAR WEIGHT: 334.83888
SMILES: C1CN(CCC1O)C2=CC=CC2=[N+]3CCC(CC3)O.O.O.[Cl-]
Structure:

CAS RN: 63887-44-5
CAS Name: 1-methyl-1-[6-(1-methyl-1-piperidin-1-iumyl)hexyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C18H38I2N2
MOLECULAR WEIGHT: 536.31666
SMILES: C[N+]1(CCCCC1)CCCCCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 63887-43-4
CAS Name: 1-ethyl-1-[6-(1-ethyl-1-piperidin-1-iumyl)hexyl]piperidin-1-ium diiodide
OPENEYE Name: 1-ethyl-1-[6-(1-ethylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
IUPAC Name: 1-ethyl-1-[6-(1-ethylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-ethyl-1-[6-(1-ethylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C20H42I2N2
MOLECULAR WEIGHT: 564.36982
SMILES: CC[N+]1(CCCCC1)CCCCCC[N+]2(CCCCC2)CC.[I-].[I-]
Structure:

CAS RN: 63887-42-3
CAS Name: 1-methyl-1-[7-(1-methyl-1-piperidin-1-iumyl)heptyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[7-(1-methylpiperidin-1-ium-1-yl)heptyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[7-(1-methylpiperidin-1-ium-1-yl)heptyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[7-(1-methylpiperidin-1-ium-1-yl)heptyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C19H40I2N2
MOLECULAR WEIGHT: 550.34324
SMILES: C[N+]1(CCCCC1)CCCCCCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 63887-41-2
CAS Name: triethyl-[2-[2-(1-ethyl-1-piperidin-1-iumyl)ethoxy]ethyl]ammonium dibromide
OPENEYE Name: triethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]ammonium dibromide
IUPAC Name: triethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium dibromide
SYSTEMATIC NAME: triethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium dibromide
MOLECULAR FORMULA: C17H38Br2N2O
MOLECULAR WEIGHT: 446.30442
SMILES: CC[N+]1(CCCCC1)CCOCC[N+](CC)(CC)CC.[Br-].[Br-]
Structure:

CAS RN: 63887-40-1
CAS Name: 1-ethyl-1-methyl-3-piperidin-1-iumcarboxylic acid methyl ester bromide
OPENEYE Name: methyl 1-ethyl-1-methyl-piperidin-1-ium-3-carboxylate bromide
IUPAC Name: methyl 1-ethyl-1-methylpiperidin-1-ium-3-carboxylate bromide
SYSTEMATIC NAME: methyl 1-ethyl-1-methyl-piperidin-1-ium-3-carboxylate bromide
MOLECULAR FORMULA: C10H20BrNO2
MOLECULAR WEIGHT: 266.1753
SMILES: CC[N+]1(CCCC(C1)C(=O)OC)C.[Br-]
Structure:

CAS RN: 63887-39-8
CAS Name: 1-ethyl-4-[2-(1-ethyl-1-pyrrolidin-1-iumyl)ethyl]-1-methylpiperidin-1-ium diiodide
OPENEYE Name: 1-ethyl-4-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethyl]-1-methyl-piperidin-1-ium diiodide
IUPAC Name: 1-ethyl-4-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethyl]-1-methylpiperidin-1-ium diiodide
SYSTEMATIC NAME: 1-ethyl-4-[2-(1-ethylpyrrolidin-1-ium-1-yl)ethyl]-1-methyl-piperidin-1-ium diiodide
MOLECULAR FORMULA: C16H34I2N2
MOLECULAR WEIGHT: 508.2635
SMILES: CC[N+]1(CCC(CC1)CC[N+]2(CCCC2)CC)C.[I-].[I-]
Structure:

CAS RN: 63887-38-7
CAS Name: ethyl-[2-(1-ethyl-1-methyl-4-piperidin-1-iumyl)ethyl]-dimethylammonium diiodide
OPENEYE Name: ethyl-[2-(1-ethyl-1-methyl-piperidin-1-ium-4-yl)ethyl]-dimethyl-ammonium diiodide
IUPAC Name: ethyl-[2-(1-ethyl-1-methylpiperidin-1-ium-4-yl)ethyl]-dimethylazanium diiodide
SYSTEMATIC NAME: ethyl-[2-(1-ethyl-1-methyl-piperidin-1-ium-4-yl)ethyl]-dimethyl-azanium diiodide
MOLECULAR FORMULA: C14H32I2N2
MOLECULAR WEIGHT: 482.22622
SMILES: CC[N+]1(CCC(CC1)CC[N+](C)(C)CC)C.[I-].[I-]
Structure:

CAS RN: 63887-37-6
CAS Name: ethyl-[2-[2-(1-ethyl-1-piperidin-1-iumyl)ethoxy]ethyl]-dimethylammonium dibromide
OPENEYE Name: ethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]-dimethyl-ammonium dibromide
IUPAC Name: ethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]-dimethylazanium dibromide
SYSTEMATIC NAME: ethyl-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]-dimethyl-azanium dibromide
MOLECULAR FORMULA: C15H34Br2N2O
MOLECULAR WEIGHT: 418.25126
SMILES: CC[N+]1(CCCCC1)CCOCC[N+](C)(C)CC.[Br-].[Br-]
Structure:

CAS RN: 63887-36-5
CAS Name: 2-(1-ethyl-1-piperidin-1-iumyl)acetic acid ethyl ester bromide
OPENEYE Name: ethyl 2-(1-ethylpiperidin-1-ium-1-yl)acetate bromide
IUPAC Name: ethyl 2-(1-ethylpiperidin-1-ium-1-yl)acetate bromide
SYSTEMATIC NAME: ethyl 2-(1-ethylpiperidin-1-ium-1-yl)ethanoate bromide
MOLECULAR FORMULA: C11H22BrNO2
MOLECULAR WEIGHT: 280.20188
SMILES: CC[N+]1(CCCCC1)CC(=O)OCC.[Br-]
Structure:

CAS RN: 63887-35-4
CAS Name: 2-(1,1-dimethyl-4-piperidin-1-iumyl)ethyl-trimethylammonium diiodide
OPENEYE Name: 2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl-trimethyl-ammonium diiodide
IUPAC Name: 2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl-trimethylazanium diiodide
SYSTEMATIC NAME: 2-(1,1-dimethylpiperidin-1-ium-4-yl)ethyl-trimethyl-azanium diiodide
MOLECULAR FORMULA: C12H28I2N2
MOLECULAR WEIGHT: 454.17306
SMILES: C[N+]1(CCC(CC1)CC[N+](C)(C)C)C.[I-].[I-]
Structure:

CAS RN: 63886-96-4
CAS Name: 4-amino-N-(1,2,4-triazol-1-yl)benzamide
OPENEYE Name: 4-amino-N-(1,2,4-triazol-1-yl)benzamide
IUPAC Name: 4-amino-N-(1,2,4-triazol-1-yl)benzamide
SYSTEMATIC NAME: 4-azanyl-N-(1,2,4-triazol-1-yl)benzamide
MOLECULAR FORMULA: C9H9N5O
MOLECULAR WEIGHT: 203.20066
SMILES: C1=CC(=CC=C1C(=O)NN2C=NC=N2)N
Structure:

CAS RN: 63886-82-8
CAS Name: 2-chloro-4-ethyl-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]dioxaphosphorin
OPENEYE Name: 2-chloro-4-ethyl-2-thioxo-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]dioxaphosphinine
IUPAC Name: 2-chloro-4-ethyl-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]dioxaphosphinine
SYSTEMATIC NAME: 2-chloranyl-4-ethyl-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]dioxaphosphinine
MOLECULAR FORMULA: C9H16ClO2PS
MOLECULAR WEIGHT: 254.713901
SMILES: CCC1C2CCCCC2OP(=S)(O1)Cl
Structure:

CAS RN: 63886-81-7
CAS Name: 5-phenyl-1,3,4-thiadiazole-2-sulfonamide
OPENEYE Name: 5-phenyl-1,3,4-thiadiazole-2-sulfonamide
IUPAC Name: 5-phenyl-1,3,4-thiadiazole-2-sulfonamide
SYSTEMATIC NAME: 5-phenyl-1,3,4-thiadiazole-2-sulfonamide
MOLECULAR FORMULA: C8H7N3O2S2
MOLECULAR WEIGHT: 241.29008
SMILES: C1=CC=C(C=C1)C2=NN=C(S2)S(=O)(=O)N
Structure:

CAS RN: 63886-72-6
CAS Name: 4,6,6-trimethyl-3-[3-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]-1H-pyrimidine-2-thione
OPENEYE Name: 4,6,6-trimethyl-3-[3-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)phenyl]-1H-pyrimidine-2-thione
IUPAC Name: 4,6,6-trimethyl-3-[3-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]-1H-pyrimidine-2-thione
SYSTEMATIC NAME: 4,6,6-trimethyl-3-[3-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]-1H-pyrimidine-2-thione
MOLECULAR FORMULA: C20H26N4S2
MOLECULAR WEIGHT: 386.57724
SMILES: CC1=CC(NC(=S)N1C2=CC(=CC=C2)N3C(=CC(NC3=S)(C)C)C)(C)C
Structure:

CAS RN: 63886-62-4
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]-1-butanone
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)butan-1-one
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)butan-1-one
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)butan-1-one
MOLECULAR FORMULA: C19H27NO2
MOLECULAR WEIGHT: 301.42318
SMILES: CCCC(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3
Structure:

CAS RN: 63886-61-3
CAS Name: 1-(8-bromo-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
OPENEYE Name: 1-(8-bromo-5-methoxy-tetralin-1-yl)pyrrolidine hydrochloride
IUPAC Name: 1-(8-bromo-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-(8-bromanyl-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine hydrochloride
MOLECULAR FORMULA: C15H21BrClNO
MOLECULAR WEIGHT: 346.69034
SMILES: COC1=C2CCCC(C2=C(C=C1)Br)N3CCCC3.Cl
Structure:

CAS RN: 63886-60-2
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)ethanone
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CC(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3
Structure:

CAS RN: 63886-59-9
CAS Name: 2,2,5,5-tetramethyl-1-propylpyrrolidine
OPENEYE Name: 2,2,5,5-tetramethyl-1-propyl-pyrrolidine
IUPAC Name: 2,2,5,5-tetramethyl-1-propylpyrrolidine
SYSTEMATIC NAME: 2,2,5,5-tetramethyl-1-propyl-pyrrolidine
MOLECULAR FORMULA: C11H23N
MOLECULAR WEIGHT: 169.30702
SMILES: CCCN1C(CCC1(C)C)(C)C
Structure:

CAS RN: 63886-58-8
CAS Name: 1-ethyl-2,2,5,5-tetramethylpyrrolidine
OPENEYE Name: 1-ethyl-2,2,5,5-tetramethyl-pyrrolidine
IUPAC Name: 1-ethyl-2,2,5,5-tetramethylpyrrolidine
SYSTEMATIC NAME: 1-ethyl-2,2,5,5-tetramethyl-pyrrolidine
MOLECULAR FORMULA: C10H21N
MOLECULAR WEIGHT: 155.28044
SMILES: CCN1C(CCC1(C)C)(C)C
Structure:

CAS RN: 63886-57-7
CAS Name: 2-ethoxy-2-phenyl-1-(1-pyrrolidinyl)ethanimine
OPENEYE Name: 2-ethoxy-2-phenyl-1-pyrrolidin-1-yl-ethanimine
IUPAC Name: 2-ethoxy-2-phenyl-1-pyrrolidin-1-ylethanimine
SYSTEMATIC NAME: 2-ethoxy-2-phenyl-1-pyrrolidin-1-yl-ethanimine
MOLECULAR FORMULA: C14H20N2O
MOLECULAR WEIGHT: 232.3214
SMILES: CCOC(C1=CC=CC=C1)C(=N)N2CCCC2
Structure:

http://ChemLookup.com Compounds

2012-02-28T04:36:00.001-08:00

CAS RN: 64023-88-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H29NO
MOLECULAR WEIGHT: 287.43966
SMILES: CCC[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CCC)C=C(C=C3)O
Structure:

CAS RN: 63903-70-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H30ClNO
MOLECULAR WEIGHT: 323.9006
SMILES: CCC[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CCC)C=C(C=C3)O.Cl
Structure:

CAS RN: 63903-69-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H26ClNO3
MOLECULAR WEIGHT: 339.85694
SMILES: CC[C@@]12CCN([C@H]([C@H]1OC(=O)C)CC3=C2C=C(C=C3)OC)C.Cl
Structure:

CAS RN: 63903-68-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24ClNO2
MOLECULAR WEIGHT: 297.82026
SMILES: CC[C@@]12CCN([C@H]([C@H]1O)CC3=C2C=C(C=C3)OC)C.Cl
Structure:

CAS RN: 63903-67-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24BrNO2
MOLECULAR WEIGHT: 342.27126
SMILES: C[C@@]12CCN([C@H]([C@]1(C)O)CC3=C2C=C(C=C3)OC)C.Br
Structure:

CAS RN: 63903-66-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H24ClNO2
MOLECULAR WEIGHT: 309.83096
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)OC(=O)C.Cl
Structure:

CAS RN: 63903-65-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrNO
MOLECULAR WEIGHT: 312.24528
SMILES: C[C@@H]1[C@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)O.Br
Structure:

CAS RN: 63903-64-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrNO
MOLECULAR WEIGHT: 312.24528
SMILES: C[C@@]12CCN([C@H]([C@@]1(C)O)CC3=CC=CC=C23)C.Br
Structure:

CAS RN: 63903-63-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26ClNO
MOLECULAR WEIGHT: 295.84744
SMILES: CC[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CC)C=C(C=C3)O.Cl
Structure:

CAS RN: 63903-62-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26ClNO
MOLECULAR WEIGHT: 295.84744
SMILES: CC[C@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CC)C=C(C=C3)O.Cl
Structure:

CAS RN: 63903-60-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H28BrNO
MOLECULAR WEIGHT: 354.32502
SMILES: CCCCN1CC[C@@]2([C@H]([C@@H]1CC3=C2C=C(C=C3)O)C)C.Br
Structure:

CAS RN: 63903-58-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrN
MOLECULAR WEIGHT: 296.24588
SMILES: C[C@@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2C)C.Br
Structure:

CAS RN: 63903-57-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26ClN
MOLECULAR WEIGHT: 279.84804
SMILES: CC[C@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2C)CC.Cl
Structure:

CAS RN: 63903-56-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26BrN
MOLECULAR WEIGHT: 324.29904
SMILES: CC[C@@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2C)CC.Br
Structure:

http://ChemLookup.com Compounds

2012-02-28T03:36:00.001-08:00

CAS RN: 63905-93-1
CAS Name: 2,2,4,6,6-pentamethyl-1,3-dihydropyridine hydrochloride
OPENEYE Name: 2,2,4,6,6-pentamethyl-1,3-dihydropyridine hydrochloride
IUPAC Name: 2,2,4,6,6-pentamethyl-1,3-dihydropyridine hydrochloride
SYSTEMATIC NAME: 2,2,4,6,6-pentamethyl-1,3-dihydropyridine hydrochloride
MOLECULAR FORMULA: C10H20ClN
MOLECULAR WEIGHT: 189.7255
SMILES: CC1=CC(NC(C1)(C)C)(C)C.Cl
Structure:

CAS RN: 63905-92-0
CAS Name: 1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
OPENEYE Name: 1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
IUPAC Name: 1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
SYSTEMATIC NAME: 1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
MOLECULAR FORMULA: C10H20ClN
MOLECULAR WEIGHT: 189.7255
SMILES: CC1(CC=CC(N1C)(C)C)C.Cl
Structure:

CAS RN: 63905-91-9
CAS Name: 4-ethynyl-1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
OPENEYE Name: 4-ethynyl-1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
IUPAC Name: 4-ethynyl-1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
SYSTEMATIC NAME: 4-ethynyl-1,2,2,6,6-pentamethyl-3H-pyridine hydrochloride
MOLECULAR FORMULA: C12H20ClN
MOLECULAR WEIGHT: 213.7469
SMILES: CC1(CC(=CC(N1C)(C)C)C#C)C.Cl
Structure:

CAS RN: 63905-59-9
CAS Name: 1-(2,5-dimethoxyphenyl)-N-methyl-2-propanamine hydrochloride
OPENEYE Name: 1-(2,5-dimethoxyphenyl)-N-methyl-propan-2-amine hydrochloride
IUPAC Name: 1-(2,5-dimethoxyphenyl)-N-methylpropan-2-amine hydrochloride
SYSTEMATIC NAME: 1-(2,5-dimethoxyphenyl)-N-methyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C12H20ClNO2
MOLECULAR WEIGHT: 245.7457
SMILES: CC(CC1=C(C=CC(=C1)OC)OC)NC.Cl
Structure:

CAS RN: 63905-51-1
CAS Name: N,N-dimethylmethanamine; 4-pyridinecarboxamide
OPENEYE Name: N,N-dimethylmethanamine; pyridine-4-carboxamide
IUPAC Name: N,N-dimethylmethanamine; pyridine-4-carboxamide
SYSTEMATIC NAME: N,N-dimethylmethanamine; pyridine-4-carboxamide
MOLECULAR FORMULA: C9H15N3O
MOLECULAR WEIGHT: 181.2349
SMILES: CN(C)C.C1=CN=CC=C1C(=O)N
Structure:

CAS RN: 63905-43-1
CAS Name: 4-[1-hydroxy-2-[methyl(2-methylpropyl)amino]ethyl]benzene-1,2-diol
OPENEYE Name: 4-[1-hydroxy-2-[isobutyl(methyl)amino]ethyl]benzene-1,2-diol
IUPAC Name: 4-[1-hydroxy-2-[methyl(2-methylpropyl)amino]ethyl]benzene-1,2-diol
SYSTEMATIC NAME: 4-[2-[methyl(2-methylpropyl)amino]-1-oxidanyl-ethyl]benzene-1,2-diol
MOLECULAR FORMULA: C13H21NO3
MOLECULAR WEIGHT: 239.31074
SMILES: CC(C)CN(C)CC(C1=CC(=C(C=C1)O)O)O
Structure:

CAS RN: 63905-27-1
CAS Name: N-[4-(2,3-dihydroxybutoxy)phenyl]acetamide
OPENEYE Name: N-[4-(2,3-dihydroxybutoxy)phenyl]acetamide
IUPAC Name: N-[4-(2,3-dihydroxybutoxy)phenyl]acetamide
SYSTEMATIC NAME: N-[4-[2,3-bis(oxidanyl)butoxy]phenyl]ethanamide
MOLECULAR FORMULA: C12H17NO4
MOLECULAR WEIGHT: 239.26768
SMILES: CC(C(COC1=CC=C(C=C1)NC(=O)C)O)O
Structure:

CAS RN: 63905-26-0
CAS Name: 3-(4-amino-2-methylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(4-amino-2-methyl-phenoxy)propane-1,2-diol
IUPAC Name: 3-(4-amino-2-methylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(4-azanyl-2-methyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C10H15NO3
MOLECULAR WEIGHT: 197.231
SMILES: CC1=C(C=CC(=C1)N)OCC(CO)O
Structure:

CAS RN: 63905-24-8
CAS Name: 3-(2-methyl-6-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-6-methyl-phenoxy)propane-1,2-diol
IUPAC Name: 3-(2-methyl-6-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(2-methyl-6-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C13H18O3
MOLECULAR WEIGHT: 222.28022
SMILES: CC1=C(C(=CC=C1)CC=C)OCC(CO)O
Structure:

CAS RN: 63905-23-7
CAS Name: 3-(4-methyl-2-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-4-methyl-phenoxy)propane-1,2-diol
IUPAC Name: 3-(4-methyl-2-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(4-methyl-2-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C13H18O3
MOLECULAR WEIGHT: 222.28022
SMILES: CC1=CC(=C(C=C1)OCC(CO)O)CC=C
Structure:

CAS RN: 63905-21-5
CAS Name: acetic acid (2-acetyloxy-3-prop-2-enoxypropyl) ester
OPENEYE Name: (2-acetoxy-3-allyloxy-propyl) acetate
IUPAC Name: (2-acetyloxy-3-prop-2-enoxypropyl) acetate
SYSTEMATIC NAME: (2-acetyloxy-3-prop-2-enoxy-propyl) ethanoate
MOLECULAR FORMULA: C10H16O5
MOLECULAR WEIGHT: 216.23104
SMILES: CC(=O)OCC(COCC=C)OC(=O)C
Structure:

CAS RN: 63905-20-4
CAS Name: 3-(2-chloro-6-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-6-chloro-phenoxy)propane-1,2-diol
IUPAC Name: 3-(2-chloro-6-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(2-chloranyl-6-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C12H15ClO3
MOLECULAR WEIGHT: 242.6987
SMILES: C=CCC1=C(C(=CC=C1)Cl)OCC(CO)O
Structure:

CAS RN: 63905-19-1
CAS Name: 3-(4-chloro-2-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-4-chloro-phenoxy)propane-1,2-diol
IUPAC Name: 3-(4-chloro-2-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(4-chloranyl-2-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C12H15ClO3
MOLECULAR WEIGHT: 242.6987
SMILES: C=CCC1=C(C=CC(=C1)Cl)OCC(CO)O
Structure:

CAS RN: 63905-18-0
CAS Name: 3-(2-bromo-6-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-6-bromo-phenoxy)propane-1,2-diol
IUPAC Name: 3-(2-bromo-6-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(2-bromanyl-6-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C12H15BrO3
MOLECULAR WEIGHT: 287.1497
SMILES: C=CCC1=C(C(=CC=C1)Br)OCC(CO)O
Structure:

CAS RN: 63905-17-9
CAS Name: 3-(4-bromo-2-prop-2-enylphenoxy)propane-1,2-diol
OPENEYE Name: 3-(2-allyl-4-bromo-phenoxy)propane-1,2-diol
IUPAC Name: 3-(4-bromo-2-prop-2-enylphenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(4-bromanyl-2-prop-2-enyl-phenoxy)propane-1,2-diol
MOLECULAR FORMULA: C12H15BrO3
MOLECULAR WEIGHT: 287.1497
SMILES: C=CCC1=C(C=CC(=C1)Br)OCC(CO)O
Structure:

CAS RN: 63905-14-6
CAS Name: N,N,2-trimethyl-3,3-diphenyl-1-propanamine hydrochloride
OPENEYE Name: N,N,2-trimethyl-3,3-diphenyl-propan-1-amine hydrochloride
IUPAC Name: N,N,2-trimethyl-3,3-diphenylpropan-1-amine hydrochloride
SYSTEMATIC NAME: N,N,2-trimethyl-3,3-diphenyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C18H24ClN
MOLECULAR WEIGHT: 289.84286
SMILES: CC(CN(C)C)C(C1=CC=CC=C1)C2=CC=CC=C2.Cl
Structure:

CAS RN: 63905-12-4
CAS Name: 2-chloro-1,3-bis(2-chloroethylthio)propane
OPENEYE Name: 2-chloro-1,3-bis(2-chloroethylsulfanyl)propane
IUPAC Name: 2-chloro-1,3-bis(2-chloroethylsulfanyl)propane
SYSTEMATIC NAME: 2-chloranyl-1,3-bis(2-chloroethylsulfanyl)propane
MOLECULAR FORMULA: C7H13Cl3S2
MOLECULAR WEIGHT: 267.66712
SMILES: C(CCl)SCC(CSCCCl)Cl
Structure:

CAS RN: 63905-09-9
CAS Name: 1,2-bis(2-chloroethylthio)propane
OPENEYE Name: 1,2-bis(2-chloroethylsulfanyl)propane
IUPAC Name: 1,2-bis(2-chloroethylsulfanyl)propane
SYSTEMATIC NAME: 1,2-bis(2-chloroethylsulfanyl)propane
MOLECULAR FORMULA: C7H14Cl2S2
MOLECULAR WEIGHT: 233.22206
SMILES: CC(CSCCCl)SCCCl
Structure:

CAS RN: 63905-06-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H38Cl2N2
MOLECULAR WEIGHT: 425.47792
SMILES: C1CCC(CC1)NCC2CC3=C(C2)C4=C(C=C3C4)CNC5CCCCC5.Cl.Cl
Structure:

CAS RN: 63905-05-5
CAS Name: 2-[2-chloroethyl(methyl)amino]ethanol hydrochloride
OPENEYE Name: 2-[2-chloroethyl(methyl)amino]ethanol hydrochloride
IUPAC Name: 2-[2-chloroethyl(methyl)amino]ethanol hydrochloride
SYSTEMATIC NAME: 2-[2-chloroethyl(methyl)amino]ethanol hydrochloride
MOLECULAR FORMULA: C5H13Cl2NO
MOLECULAR WEIGHT: 174.06882
SMILES: CN(CCO)CCCl.Cl
Structure:

CAS RN: 63905-03-3
CAS Name: N,N-bis(2-chloroethyl)-4-(4-methylphenyl)sulfonyl-2-morpholinamine
OPENEYE Name: N,N-bis(2-chloroethyl)-4-(p-tolylsulfonyl)morpholin-2-amine
IUPAC Name: N,N-bis(2-chloroethyl)-4-(4-methylphenyl)sulfonylmorpholin-2-amine
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-4-(4-methylphenyl)sulfonyl-morpholin-2-amine
MOLECULAR FORMULA: C15H22Cl2N2O3S
MOLECULAR WEIGHT: 381.31778
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCOC(C2)N(CCCl)CCCl
Structure:

CAS RN: 63904-90-5
CAS Name: triethyl-(4-methylphenyl)phosphonium iodide
OPENEYE Name: triethyl(p-tolyl)phosphonium iodide
IUPAC Name: triethyl-(4-methylphenyl)phosphanium iodide
SYSTEMATIC NAME: triethyl-(4-methylphenyl)phosphanium iodide
MOLECULAR FORMULA: C13H22IP
MOLECULAR WEIGHT: 336.192011
SMILES: CC[P+](CC)(CC)C1=CC=C(C=C1)C.[I-]
Structure:

CAS RN: 63904-89-2
CAS Name: 1,6-bis(dibutoxyphosphoryl)hexane
OPENEYE Name: 1,6-bis(dibutoxyphosphoryl)hexane
IUPAC Name: 1,6-bis(dibutoxyphosphoryl)hexane
SYSTEMATIC NAME: 1,6-bis(dibutoxyphosphoryl)hexane
MOLECULAR FORMULA: C22H48O6P2
MOLECULAR WEIGHT: 470.560442
SMILES: CCCCOP(=O)(CCCCCCP(=O)(OCCCC)OCCCC)OCCCC
Structure:

CAS RN: 63904-84-7
CAS Name: morpholine; platinum(2+); dichloride
OPENEYE Name: morpholine; platinum(2+); dichloride
IUPAC Name: morpholine; platinum(2+); dichloride
SYSTEMATIC NAME: morpholine; platinum(2+); dichloride
MOLECULAR FORMULA: C8H18Cl2N2O2Pt
MOLECULAR WEIGHT: 440.22472
SMILES: C1COCCN1.C1COCCN1.[Cl-].[Cl-].[Pt+2]
Structure:

CAS RN: 63904-83-6
CAS Name: zinc N-prop-2-enylcarbamodithioate
OPENEYE Name: zinc N-allylcarbamodithioate
IUPAC Name: zinc N-prop-2-enylcarbamodithioate
SYSTEMATIC NAME: zinc N-prop-2-enylcarbamodithioate
MOLECULAR FORMULA: C8H12N2S4Zn
MOLECULAR WEIGHT: 329.86328
SMILES: C=CCNC(=S)[S-].C=CCNC(=S)[S-].[Zn+2]
Structure:

CAS RN: 63904-82-5
CAS Name: sodium; 2-hydroxypropanoate; oxozirconium(2+)
OPENEYE Name: sodium; 2-hydroxypropanoate; oxozirconium(2+)
IUPAC Name: sodium; 2-hydroxypropanoate; oxozirconium(2+)
SYSTEMATIC NAME: sodium; oxidanylidenezirconium(2+); 2-oxidanylpropanoate
MOLECULAR FORMULA: C9H15NaO10Zr
MOLECULAR WEIGHT: 397.42317
SMILES: CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.O=[Zr+2].[Na+]
Structure:

CAS RN: 63903-78-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrNO2
MOLECULAR WEIGHT: 328.24468
SMILES: C[C@@]12CCN([C@H]([C@@H]1O)CC3=C2C=C(C=C3)OC)C.Br
Structure:

CAS RN: 63903-77-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H30BrNO2
MOLECULAR WEIGHT: 432.3938
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=C(C=C4)OC)C)C=C(C=C3)O.Br
Structure:

CAS RN: 63903-76-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H27NO2
MOLECULAR WEIGHT: 349.46598
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC(=O)C4=CC=CC=C4)C)C=C(C=C3)O
Structure:

CAS RN: 63903-75-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28BrNO
MOLECULAR WEIGHT: 402.36782
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O.Br
Structure:

CAS RN: 63903-74-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28BrNO
MOLECULAR WEIGHT: 402.36782
SMILES: C[C@@H]1[C@@H]2CC3=C([C@]1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O.Br
Structure:

CAS RN: 63903-73-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26ClNO
MOLECULAR WEIGHT: 295.84744
SMILES: CCCN1CC[C@@]2([C@H]([C@@H]1CC3=C2C=C(C=C3)O)C)C.Cl
Structure:

CAS RN: 63903-72-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H25NOS
MOLECULAR WEIGHT: 327.4836
SMILES: C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=CS4)C)C=C(C=C3)O
Structure:

CAS RN: 63903-71-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H30ClNO
MOLECULAR WEIGHT: 323.9006
SMILES: CCC[C@H]1[C@@H]2CC3=C([C@@]1(CCN2C)CCC)C=C(C=C3)O.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T02:36:00.001-08:00

CAS RN: 63906-29-6
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[2-[di(propan-2-yl)amino]ethyl] ester hydrochloride
OPENEYE Name: S-[2-(diisopropylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[2-[di(propan-2-yl)amino]ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[2-[di(propan-2-yl)amino]ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C20H26ClN3OS2
MOLECULAR WEIGHT: 424.02294
SMILES: CC(C)N(CCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63906-28-5
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-(diethylamino)propyl] ester hydrochloride
OPENEYE Name: S-[3-(diethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[3-(diethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[3-(diethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C19H24ClN3OS2
MOLECULAR WEIGHT: 409.99636
SMILES: CCN(CC)CCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63906-27-4
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[1-(diethylamino)propan-2-yl] ester hydrochloride
OPENEYE Name: S-[2-(diethylamino)-1-methyl-ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[1-(diethylamino)propan-2-yl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[1-(diethylamino)propan-2-yl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C19H24ClN3OS2
MOLECULAR WEIGHT: 409.99636
SMILES: CCN(CC)CC(C)SC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63906-26-3
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[2-(diethylamino)ethyl] ester hydrochloride
OPENEYE Name: S-[2-(diethylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[2-(diethylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[2-(diethylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C18H22ClN3OS2
MOLECULAR WEIGHT: 395.96978
SMILES: CCN(CC)CCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63906-25-2
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[2-(dibutylamino)ethyl] ester hydrochloride
OPENEYE Name: S-[2-(dibutylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[2-(dibutylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[2-(dibutylamino)ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C22H30ClN3OS2
MOLECULAR WEIGHT: 452.0761
SMILES: CCCCN(CCCC)CCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63906-24-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H19ClN2O
MOLECULAR WEIGHT: 314.80926
SMILES: C1C=C2CNCC(N3C2=C(C1O)CC=C3Cl)C4=CC=CC=C4
Structure:

CAS RN: 63906-23-0
CAS Name: 1-[2-[2-(1-pyridin-1-iumyl)ethylthio]ethyl]pyridin-1-ium dichloride
OPENEYE Name: 1-[2-(2-pyridin-1-ium-1-ylethylsulfanyl)ethyl]pyridin-1-ium dichloride
IUPAC Name: 1-[2-(2-pyridin-1-ium-1-ylethylsulfanyl)ethyl]pyridin-1-ium dichloride
SYSTEMATIC NAME: 1-[2-(2-pyridin-1-ium-1-ylethylsulfanyl)ethyl]pyridin-1-ium dichloride
MOLECULAR FORMULA: C14H18Cl2N2S
MOLECULAR WEIGHT: 317.27712
SMILES: C1=CC=[N+](C=C1)CCSCC[N+]2=CC=CC=C2.[Cl-].[Cl-]
Structure:

CAS RN: 63906-22-9
CAS Name: 1-[4-(hydroxymethyl)-1-pyridin-1-iumyl]-2-[4-[4-[2-[4-(hydroxymethyl)-1-pyridin-1-iumyl]-2-oxoethyl]phenoxy]phenyl]ethanone dibromide
OPENEYE Name: 1-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxo-ethyl]phenoxy]phenyl]ethanone dibromide
IUPAC Name: 1-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxoethyl]phenoxy]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[4-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]phenoxy]phenyl]ethanone dibromide
MOLECULAR FORMULA: C28H26Br2N2O5
MOLECULAR WEIGHT: 630.32444
SMILES: C1=CC(=CC=C1CC(=O)[N+]2=CC=C(C=C2)CO)OC3=CC=C(C=C3)CC(=O)[N+]4=CC=C(C=C4)CO.[Br-].[Br-]
Structure:

CAS RN: 63906-21-8
CAS Name: 1-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-2-[4-[4-[2-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-2-oxoethyl]phenoxy]phenyl]ethanone dibromide
OPENEYE Name: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxo-ethyl]phenoxy]phenyl]ethanone dibromide
IUPAC Name: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxoethyl]phenoxy]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]phenoxy]phenyl]ethanone dibromide
MOLECULAR FORMULA: C28H26Br2N2O5
MOLECULAR WEIGHT: 630.32444
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)OC3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)CO)CO.[Br-].[Br-]
Structure:

CAS RN: 63906-20-7
CAS Name: [2-(hydroxymethyl)-1-pyridin-1-iumyl]-[7-[[7-[[2-(hydroxymethyl)-1-pyridin-1-iumyl]-oxomethyl]-7-bicyclo[2.2.1]hepta-1,3-dienyl]oxy]-7-bicyclo[2.2.1]hepta-1,3-dienyl]methanone dibromide
OPENEYE Name: [7-[[7-[2-(hydroxymethyl)pyridin-1-ium-1-carbonyl]-7-bicyclo[2.2.1]hepta-1,3-dienyl]oxy]-7-bicyclo[2.2.1]hepta-1,3-dienyl]-[2-(hydroxymethyl)pyridin-1-ium-1-yl]methanone dibromide
IUPAC Name: [7-[[7-[2-(hydroxymethyl)pyridin-1-ium-1-carbonyl]-7-bicyclo[2.2.1]hepta-1,3-dienyl]oxy]-7-bicyclo[2.2.1]hepta-1,3-dienyl]-[2-(hydroxymethyl)pyridin-1-ium-1-yl]methanone dibromide
SYSTEMATIC NAME: [2-(hydroxymethyl)pyridin-1-ium-1-yl]-[7-[[7-[2-(hydroxymethyl)pyridin-1-ium-1-yl]carbonyl-7-bicyclo[2.2.1]hepta-1,3-dienyl]oxy]-7-bicyclo[2.2.1]hepta-1,3-dienyl]methanone dibromide
MOLECULAR FORMULA: C28H26Br2N2O5
MOLECULAR WEIGHT: 630.32444
SMILES: C1CC2=CC=C1C2(C(=O)[N+]3=CC=CC=C3CO)OC4(C5=CC=C4CC5)C(=O)[N+]6=CC=CC=C6CO.[Br-].[Br-]
Structure:

CAS RN: 63906-19-4
CAS Name: 1-methyl-4-[2-(phenylthio)ethyl]pyridin-1-ium bromide
OPENEYE Name: 1-methyl-4-(2-phenylsulfanylethyl)pyridin-1-ium bromide
IUPAC Name: 1-methyl-4-(2-phenylsulfanylethyl)pyridin-1-ium bromide
SYSTEMATIC NAME: 1-methyl-4-(2-phenylsulfanylethyl)pyridin-1-ium bromide
MOLECULAR FORMULA: C14H16BrNS
MOLECULAR WEIGHT: 310.25254
SMILES: C[N+]1=CC=C(C=C1)CCSC2=CC=CC=C2.[Br-]
Structure:

CAS RN: 63906-18-3
CAS Name: N,N-dimethylcarbamic acid [3-[2-(1-methyl-2-pyridin-1-iumyl)ethyl]phenyl] ester iodide
OPENEYE Name: [3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenyl] N,N-dimethylcarbamate iodide
IUPAC Name: [3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenyl] N,N-dimethylcarbamate iodide
SYSTEMATIC NAME: [3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenyl] N,N-dimethylcarbamate iodide
MOLECULAR FORMULA: C17H21IN2O2
MOLECULAR WEIGHT: 412.26531
SMILES: C[N+]1=CC=CC=C1CCC2=CC(=CC=C2)OC(=O)N(C)C.[I-]
Structure:

CAS RN: 63906-17-2
CAS Name: trimethyl-[3-[4-(triphenylmethyl)-1-pyridin-1-iumyl]propyl]ammonium dibromide
OPENEYE Name: trimethyl-[3-(4-tritylpyridin-1-ium-1-yl)propyl]ammonium dibromide
IUPAC Name: trimethyl-[3-(4-tritylpyridin-1-ium-1-yl)propyl]azanium dibromide
SYSTEMATIC NAME: trimethyl-[3-[4-(triphenylmethyl)pyridin-1-ium-1-yl]propyl]azanium dibromide
MOLECULAR FORMULA: C30H34Br2N2
MOLECULAR WEIGHT: 582.41236
SMILES: C[N+](C)(C)CCC[N+]1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-].[Br-]
Structure:

CAS RN: 63906-15-0
CAS Name: 3-[4-(diphenylmethyl)-1-pyridin-1-iumyl]propyl-trimethylammonium dibromide
OPENEYE Name: 3-(4-benzhydrylpyridin-1-ium-1-yl)propyl-trimethyl-ammonium dibromide
IUPAC Name: 3-(4-benzhydrylpyridin-1-ium-1-yl)propyl-trimethylazanium dibromide
SYSTEMATIC NAME: 3-[4-(diphenylmethyl)pyridin-1-ium-1-yl]propyl-trimethyl-azanium dibromide
MOLECULAR FORMULA: C24H30Br2N2
MOLECULAR WEIGHT: 506.3164
SMILES: C[N+](C)(C)CCC[N+]1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Br-].[Br-]
Structure:

CAS RN: 63906-13-8
CAS Name: N-(2-chloroethyl)-N-methyl-2-(1-pyridin-1-iumyl)ethanamine chloride hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-methyl-2-pyridin-1-ium-1-yl-ethanamine chloride hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-methyl-2-pyridin-1-ium-1-ylethanamine chloride hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-methyl-2-pyridin-1-ium-1-yl-ethanamine chloride hydrochloride
MOLECULAR FORMULA: C10H17Cl3N2
MOLECULAR WEIGHT: 271.61438
SMILES: CN(CC[N+]1=CC=CC=C1)CCCl.Cl.[Cl-]
Structure:

CAS RN: 63906-12-7
CAS Name: N-(2-chloroethyl)-N-ethyl-2-(1-pyridin-1-iumyl)ethanamine chloride hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-ethyl-2-pyridin-1-ium-1-yl-ethanamine chloride hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-ethyl-2-pyridin-1-ium-1-ylethanamine chloride hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-ethyl-2-pyridin-1-ium-1-yl-ethanamine chloride hydrochloride
MOLECULAR FORMULA: C11H19Cl3N2
MOLECULAR WEIGHT: 285.64096
SMILES: CCN(CC[N+]1=CC=CC=C1)CCCl.Cl.[Cl-]
Structure:

CAS RN: 63906-11-6
CAS Name: 1-tetradecyl-3-pyridin-1-iumcarboxamide chloride
OPENEYE Name: 1-tetradecylpyridin-1-ium-3-carboxamide chloride
IUPAC Name: 1-tetradecylpyridin-1-ium-3-carboxamide chloride
SYSTEMATIC NAME: 1-tetradecylpyridin-1-ium-3-carboxamide chloride
MOLECULAR FORMULA: C20H35ClN2O
MOLECULAR WEIGHT: 354.9577
SMILES: CCCCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)N.[Cl-]
Structure:

CAS RN: 63906-10-5
CAS Name: 1-hexadecyl-3-pyridin-1-iumcarboxamide chloride
OPENEYE Name: 1-hexadecylpyridin-1-ium-3-carboxamide chloride
IUPAC Name: 1-hexadecylpyridin-1-ium-3-carboxamide chloride
SYSTEMATIC NAME: 1-hexadecylpyridin-1-ium-3-carboxamide chloride
MOLECULAR FORMULA: C22H39ClN2O
MOLECULAR WEIGHT: 383.01086
SMILES: CCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)C(=O)N.[Cl-]
Structure:

CAS RN: 63906-09-2
CAS Name: 1-(2-bromoethyl)-3-pyridin-1-iumcarboxamide bromide
OPENEYE Name: 1-(2-bromoethyl)pyridin-1-ium-3-carboxamide bromide
IUPAC Name: 1-(2-bromoethyl)pyridin-1-ium-3-carboxamide bromide
SYSTEMATIC NAME: 1-(2-bromoethyl)pyridin-1-ium-3-carboxamide bromide
MOLECULAR FORMULA: C8H10Br2N2O
MOLECULAR WEIGHT: 309.9858
SMILES: C1=CC(=C[N+](=C1)CCBr)C(=O)N.[Br-]
Structure:

CAS RN: 63906-08-1
CAS Name: 2-[4-[4-[2-oxo-2-(1-pyridin-1-iumyl)ethyl]phenyl]phenyl]-1-(1-pyridin-1-iumyl)ethanone dibromide
OPENEYE Name: 2-[4-[4-(2-oxo-2-pyridin-1-ium-1-yl-ethyl)phenyl]phenyl]-1-pyridin-1-ium-1-yl-ethanone dibromide
IUPAC Name: 2-[4-[4-(2-oxo-2-pyridin-1-ium-1-ylethyl)phenyl]phenyl]-1-pyridin-1-ium-1-ylethanone dibromide
SYSTEMATIC NAME: 2-[4-[4-(2-oxidanylidene-2-pyridin-1-ium-1-yl-ethyl)phenyl]phenyl]-1-pyridin-1-ium-1-yl-ethanone dibromide
MOLECULAR FORMULA: C26H22Br2N2O2
MOLECULAR WEIGHT: 554.27308
SMILES: C1=CC=[N+](C=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC=C4.[Br-].[Br-]
Structure:

CAS RN: 63906-07-0
CAS Name: 1-(3-iodo-1-pyridin-1-iumyl)-2-[4-[4-[2-(3-iodo-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-(3-iodopyridin-1-ium-1-yl)-2-[4-[4-[2-(3-iodopyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-(3-iodopyridin-1-ium-1-yl)-2-[4-[4-[2-(3-iodopyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-(3-iodanylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-iodanylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C26H20Br2I2N2O2
MOLECULAR WEIGHT: 806.06614
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)I)I.[Br-].[Br-]
Structure:

CAS RN: 63906-06-9
CAS Name: 1-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-2-[4-[4-[2-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C28H26Br2N2O4
MOLECULAR WEIGHT: 614.32504
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)CO)CO.[Br-].[Br-]
Structure:

CAS RN: 63906-05-8
CAS Name: 1-[2-(hydroxymethyl)-1-pyridin-1-iumyl]-2-[4-[4-[2-[2-(hydroxymethyl)-1-pyridin-1-iumyl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-[4-[4-[2-[2-(hydroxymethyl)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C28H26Br2N2O4
MOLECULAR WEIGHT: 614.32504
SMILES: C1=CC=[N+](C(=C1)CO)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC=C4CO.[Br-].[Br-]
Structure:

CAS RN: 63906-04-7
CAS Name: 1-[2-[4-[4-[2-(3-formyl-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]-1-oxoethyl]-3-pyridin-1-iumcarboxaldehyde dibromide
OPENEYE Name: 1-[2-[4-[4-[2-(3-formylpyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]acetyl]pyridin-1-ium-3-carbaldehyde dibromide
IUPAC Name: 1-[2-[4-[4-[2-(3-formylpyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]acetyl]pyridin-1-ium-3-carbaldehyde dibromide
SYSTEMATIC NAME: 1-[2-[4-[4-[2-(3-methanoylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanoyl]pyridin-1-ium-3-carbaldehyde dibromide
MOLECULAR FORMULA: C28H22Br2N2O4
MOLECULAR WEIGHT: 610.29328
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)C=O)C=O.[Br-].[Br-]
Structure:

CAS RN: 63906-03-6
CAS Name: 1-(3-ethyl-1-pyridin-1-iumyl)-2-[4-[4-[2-(3-ethyl-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-(3-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-ethylpyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-(3-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-ethylpyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-(3-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-ethylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C30H30Br2N2O2
MOLECULAR WEIGHT: 610.3794
SMILES: CCC1=C[N+](=CC=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)CC.[Br-].[Br-]
Structure:

CAS RN: 63906-02-5
CAS Name: 1-(2-ethyl-1-pyridin-1-iumyl)-2-[4-[4-[2-(2-ethyl-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-(2-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(2-ethylpyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-(2-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(2-ethylpyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-(2-ethylpyridin-1-ium-1-yl)-2-[4-[4-[2-(2-ethylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C30H30Br2N2O2
MOLECULAR WEIGHT: 610.3794
SMILES: CCC1=CC=CC=[N+]1C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC=C4CC.[Br-].[Br-]
Structure:

CAS RN: 63906-01-4
CAS Name: 1-(3-chloro-1-pyridin-1-iumyl)-2-[4-[4-[2-(3-chloro-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-(3-chloropyridin-1-ium-1-yl)-2-[4-[4-[2-(3-chloropyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-(3-chloropyridin-1-ium-1-yl)-2-[4-[4-[2-(3-chloropyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-(3-chloranylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-chloranylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C26H20Br2Cl2N2O2
MOLECULAR WEIGHT: 623.1632
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)Cl)Cl.[Br-].[Br-]
Structure:

CAS RN: 63906-00-3
CAS Name: 1-(3-bromo-1-pyridin-1-iumyl)-2-[4-[4-[2-(3-bromo-1-pyridin-1-iumyl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
OPENEYE Name: 1-(3-bromopyridin-1-ium-1-yl)-2-[4-[4-[2-(3-bromopyridin-1-ium-1-yl)-2-oxo-ethyl]phenyl]phenyl]ethanone dibromide
IUPAC Name: 1-(3-bromopyridin-1-ium-1-yl)-2-[4-[4-[2-(3-bromopyridin-1-ium-1-yl)-2-oxoethyl]phenyl]phenyl]ethanone dibromide
SYSTEMATIC NAME: 1-(3-bromanylpyridin-1-ium-1-yl)-2-[4-[4-[2-(3-bromanylpyridin-1-ium-1-yl)-2-oxidanylidene-ethyl]phenyl]phenyl]ethanone dibromide
MOLECULAR FORMULA: C26H20Br4N2O2
MOLECULAR WEIGHT: 712.0652
SMILES: C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)Br)Br.[Br-].[Br-]
Structure:

CAS RN: 63905-99-7
CAS Name: trimethyl-[6-[4-(phenylmethyl)-1-pyridin-1-iumyl]hexyl]ammonium dibromide
OPENEYE Name: 6-(4-benzylpyridin-1-ium-1-yl)hexyl-trimethyl-ammonium dibromide
IUPAC Name: 6-(4-benzylpyridin-1-ium-1-yl)hexyl-trimethylazanium dibromide
SYSTEMATIC NAME: trimethyl-[6-[4-(phenylmethyl)pyridin-1-ium-1-yl]hexyl]azanium dibromide
MOLECULAR FORMULA: C21H32Br2N2
MOLECULAR WEIGHT: 472.30018
SMILES: C[N+](C)(C)CCCCCC[N+]1=CC=C(C=C1)CC2=CC=CC=C2.[Br-].[Br-]
Structure:

CAS RN: 63905-98-6
CAS Name: 1-(diphenylmethyl)-4-pentylpyridin-1-ium bromide
OPENEYE Name: 1-benzhydryl-4-pentyl-pyridin-1-ium bromide
IUPAC Name: 1-benzhydryl-4-pentylpyridin-1-ium bromide
SYSTEMATIC NAME: 1-(diphenylmethyl)-4-pentyl-pyridin-1-ium bromide
MOLECULAR FORMULA: C23H26BrN
MOLECULAR WEIGHT: 396.36324
SMILES: CCCCCC1=CC=[N+](C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
Structure:

CAS RN: 63905-97-5
CAS Name: acetic acid 1-pyridin-1-iumylmethyl ester chloride
OPENEYE Name: pyridin-1-ium-1-ylmethyl acetate chloride
IUPAC Name: pyridin-1-ium-1-ylmethyl acetate chloride
SYSTEMATIC NAME: pyridin-1-ium-1-ylmethyl ethanoate chloride
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: CC(=O)OC[N+]1=CC=CC=C1.[Cl-]
Structure:

CAS RN: 63905-96-4
CAS Name: 3,5-diiodo-1H-pyridine-4-thione
OPENEYE Name: 3,5-diiodo-1H-pyridine-4-thione
IUPAC Name: 3,5-diiodo-1H-pyridine-4-thione
SYSTEMATIC NAME: 3,5-bis(iodanyl)-1H-pyridine-4-thione
MOLECULAR FORMULA: C5H3I2NS
MOLECULAR WEIGHT: 362.95796
SMILES: C1=C(C(=S)C(=CN1)I)I
Structure:

CAS RN: 63905-95-3
CAS Name: 3,5-dibromo-1H-pyridine-4-thione
OPENEYE Name: 3,5-dibromo-1H-pyridine-4-thione
IUPAC Name: 3,5-dibromo-1H-pyridine-4-thione
SYSTEMATIC NAME: 3,5-bis(bromanyl)-1H-pyridine-4-thione
MOLECULAR FORMULA: C5H3Br2NS
MOLECULAR WEIGHT: 268.95702
SMILES: C1=C(C(=S)C(=CN1)Br)Br
Structure:

CAS RN: 63905-94-2
CAS Name: 1,2,2,6-tetramethyl-3,4-dihydropyridine hydrochloride
OPENEYE Name: 1,2,2,6-tetramethyl-3,4-dihydropyridine hydrochloride
IUPAC Name: 1,2,2,6-tetramethyl-3,4-dihydropyridine hydrochloride
SYSTEMATIC NAME: 1,2,2,6-tetramethyl-3,4-dihydropyridine hydrochloride
MOLECULAR FORMULA: C9H18ClN
MOLECULAR WEIGHT: 175.69892
SMILES: CC1=CCCC(N1C)(C)C.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T01:36:00.001-08:00

CAS RN: 63906-92-3
CAS Name: phosphoric acid [butoxy(dibutoxyphosphoryloxy)phosphoryl] diethoxyphosphoryl ethyl ester
OPENEYE Name: [butoxy(dibutoxyphosphoryloxy)phosphoryl] diethoxyphosphoryl ethyl phosphate
IUPAC Name: [butoxy(dibutoxyphosphoryloxy)phosphoryl] diethoxyphosphoryl ethyl phosphate
SYSTEMATIC NAME: [butoxy(dibutoxyphosphoryloxy)phosphoryl] diethoxyphosphoryl ethyl phosphate
MOLECULAR FORMULA: C18H42O13P4
MOLECULAR WEIGHT: 590.413324
SMILES: CCCCOP(=O)(OCCCC)OP(=O)(OCCCC)OP(=O)(OCC)OP(=O)(OCC)OCC
Structure:

CAS RN: 63906-76-3
CAS Name: formic acid; 4-methyl-2-thiazolamine
OPENEYE Name: formic acid; 4-methylthiazol-2-amine
IUPAC Name: formic acid; 4-methyl-1,3-thiazol-2-amine
SYSTEMATIC NAME: methanoic acid; 4-methyl-1,3-thiazol-2-amine
MOLECULAR FORMULA: C5H8N2O2S
MOLECULAR WEIGHT: 160.19422
SMILES: CC1=CSC(=N1)N.C(=O)O
Structure:

CAS RN: 63906-74-1
CAS Name: 4,5-dimethyl-6-phenyl-3-sulfanylidene-2-morpholinone
OPENEYE Name: 4,5-dimethyl-6-phenyl-3-thioxo-morpholin-2-one
IUPAC Name: 4,5-dimethyl-6-phenyl-3-sulfanylidenemorpholin-2-one
SYSTEMATIC NAME: 4,5-dimethyl-6-phenyl-3-sulfanylidene-morpholin-2-one
MOLECULAR FORMULA: C12H13NO2S
MOLECULAR WEIGHT: 235.30212
SMILES: CC1C(OC(=O)C(=S)N1C)C2=CC=CC=C2
Structure:

CAS RN: 63906-72-9
CAS Name: 5-amino-1,2,4-thiadiazole-3-thione hydrochloride
OPENEYE Name: 5-amino-1,2,4-thiadiazole-3-thione hydrochloride
IUPAC Name: 5-amino-1,2,4-thiadiazole-3-thione hydrochloride
SYSTEMATIC NAME: 5-azanyl-1,2,4-thiadiazole-3-thione hydrochloride
MOLECULAR FORMULA: C2H4ClN3S2
MOLECULAR WEIGHT: 169.65626
SMILES: C1(=NC(=S)NS1)N.Cl
Structure:

CAS RN: 63906-71-8
CAS Name: N-(1-cyclohexa-2,5-dienylideneamino)-1,3,4-thiadiazol-2-amine
OPENEYE Name: N-(cyclohexa-2,5-dien-1-ylideneamino)-1,3,4-thiadiazol-2-amine
IUPAC Name: N-(cyclohexa-2,5-dien-1-ylideneamino)-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: N-(cyclohexa-2,5-dien-1-ylideneamino)-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C8H8N4S
MOLECULAR WEIGHT: 192.24092
SMILES: C1C=CC(=NNC2=NN=CS2)C=C1
Structure:

CAS RN: 63906-70-7
CAS Name: 5-(2-hydroxyethyl)-3-methyl-1,3,5-thiadiazinane-2-thione
OPENEYE Name: 5-(2-hydroxyethyl)-3-methyl-1,3,5-thiadiazinane-2-thione
IUPAC Name: 5-(2-hydroxyethyl)-3-methyl-1,3,5-thiadiazinane-2-thione
SYSTEMATIC NAME: 5-(2-hydroxyethyl)-3-methyl-1,3,5-thiadiazinane-2-thione
MOLECULAR FORMULA: C6H12N2OS2
MOLECULAR WEIGHT: 192.30228
SMILES: CN1CN(CSC1=S)CCO
Structure:

CAS RN: 63906-64-9
CAS Name: 7-[2-amino-1-(4-morpholinyl)ethyl]-1,3-dimethyl-8-(phenylmethyl)purine-2,6-dione hydrochloride
OPENEYE Name: 7-(2-amino-1-morpholino-ethyl)-8-benzyl-1,3-dimethyl-purine-2,6-dione hydrochloride
IUPAC Name: 7-(2-amino-1-morpholin-4-ylethyl)-8-benzyl-1,3-dimethylpurine-2,6-dione hydrochloride
SYSTEMATIC NAME: 7-(2-azanyl-1-morpholin-4-yl-ethyl)-1,3-dimethyl-8-(phenylmethyl)purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C20H27ClN6O3
MOLECULAR WEIGHT: 434.91978
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=CC=C3)C(CN)N4CCOCC4.Cl
Structure:

CAS RN: 63906-61-6
CAS Name: 1-(2-methoxyethyl)-3,7-dimethylpurine-2,6-dione
OPENEYE Name: 1-(2-methoxyethyl)-3,7-dimethyl-purine-2,6-dione
IUPAC Name: 1-(2-methoxyethyl)-3,7-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 1-(2-methoxyethyl)-3,7-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C10H14N4O3
MOLECULAR WEIGHT: 238.24316
SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2C)CCOC
Structure:

CAS RN: 63906-60-5
CAS Name: 1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione; nitric acid
OPENEYE Name: 1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione; nitric acid
IUPAC Name: 1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione; nitric acid
SYSTEMATIC NAME: 1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione; nitric acid
MOLECULAR FORMULA: C9H13N5O6
MOLECULAR WEIGHT: 287.22942
SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2C)CCO.[N+](=O)(O)[O-]
Structure:

CAS RN: 63906-59-2
CAS Name: 8-chloro-1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione; nitric acid
OPENEYE Name: 8-chloro-1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione; nitric acid
IUPAC Name: 8-chloro-1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione; nitric acid
SYSTEMATIC NAME: 8-chloranyl-1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione; nitric acid
MOLECULAR FORMULA: C9H12ClN5O6
MOLECULAR WEIGHT: 321.67448
SMILES: CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)CCO)C.[N+](=O)(O)[O-]
Structure:

CAS RN: 63906-54-7
CAS Name: N-(1-piperidinyl)carbamodithioic acid [[(1-piperidinylamino)-sulfanylidenemethyl]trisulfanyl] ester
OPENEYE Name: (1-piperidylcarbamothioyltrisulfanyl) N-(1-piperidyl)carbamodithioate
IUPAC Name: (piperidin-1-ylcarbamothioyltrisulfanyl) N-piperidin-1-ylcarbamodithioate
SYSTEMATIC NAME: (piperidin-1-ylcarbamothioyltrisulfanyl) N-piperidin-1-ylcarbamodithioate
MOLECULAR FORMULA: C12H22N4S6
MOLECULAR WEIGHT: 414.71988
SMILES: C1CCN(CC1)NC(=S)SSSSC(=S)NN2CCCCC2
Structure:

CAS RN: 63906-33-2
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-(dimethylamino)propyl] ester hydrochloride
OPENEYE Name: S-[3-(dimethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[3-(dimethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[3-(dimethylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C17H20ClN3OS2
MOLECULAR WEIGHT: 381.9432
SMILES: CN(C)CCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3.Cl
Structure:

CAS RN: 63906-32-1
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[3-[di(propan-2-yl)amino]propyl] ester
OPENEYE Name: S-[3-(diisopropylamino)propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate
IUPAC Name: S-[3-[di(propan-2-yl)amino]propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate
SYSTEMATIC NAME: S-[3-[di(propan-2-yl)amino]propyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate
MOLECULAR FORMULA: C21H27N3OS2
MOLECULAR WEIGHT: 401.58858
SMILES: CC(C)N(CCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C
Structure:

CAS RN: 63906-31-0
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[1-[di(propan-2-yl)amino]propan-2-yl] ester hydrochloride
OPENEYE Name: S-[2-(diisopropylamino)-1-methyl-ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[1-[di(propan-2-yl)amino]propan-2-yl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[1-[di(propan-2-yl)amino]propan-2-yl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C21H28ClN3OS2
MOLECULAR WEIGHT: 438.04952
SMILES: CC(C)N(CC(C)SC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

CAS RN: 63906-30-9
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarbothioic acid S-[2-[2-[di(propan-2-yl)amino]ethylthio]ethyl] ester hydrochloride
OPENEYE Name: S-[2-[2-(diisopropylamino)ethylsulfanyl]ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
IUPAC Name: S-[2-[2-[di(propan-2-yl)amino]ethylsulfanyl]ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
SYSTEMATIC NAME: S-[2-[2-[di(propan-2-yl)amino]ethylsulfanyl]ethyl] pyrido[3,2-b][1,4]benzothiazine-10-carbothioate hydrochloride
MOLECULAR FORMULA: C22H30ClN3OS3
MOLECULAR WEIGHT: 484.1411
SMILES: CC(C)N(CCSCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-28T00:34:00.001-08:00

CAS RN: 63915-80-0
CAS Name: 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(4-morpholinyl)ethyl ester hydrochloride
OPENEYE Name: 2-morpholinoethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
IUPAC Name: 2-morpholin-4-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
SYSTEMATIC NAME: 2-morpholin-4-ylethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate hydrochloride
MOLECULAR FORMULA: C18H20ClN3O3S
MOLECULAR WEIGHT: 393.8877
SMILES: C1COCCN1CCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63915-79-7
CAS Name: diethyl-methyl-[2-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]ethyl]ammonium diiodide
OPENEYE Name: diethyl-methyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]ammonium diiodide
IUPAC Name: diethyl-methyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
SYSTEMATIC NAME: diethyl-methyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
MOLECULAR FORMULA: C15H34I2N2O
MOLECULAR WEIGHT: 512.2522
SMILES: CC[N+](C)(CC)CCOCC[N+]1(CCCCC1)C.[I-].[I-]
Structure:

CAS RN: 63915-76-4
CAS Name: beryllium sodium 2-oxidobutanedioate
OPENEYE Name: beryllium sodium 2-oxidobutanedioate
IUPAC Name: beryllium sodium 2-oxidobutanedioate
SYSTEMATIC NAME: beryllium sodium 2-oxidanidylbutanedioate
MOLECULAR FORMULA: C4H3BeNaO5
MOLECULAR WEIGHT: 163.065572
SMILES: [Be+2].C(C(C(=O)[O-])[O-])C(=O)[O-].[Na+]
Structure:

CAS RN: 63915-59-3
CAS Name: thiocyanic acid 2-[methyl(2-thiocyanatoethyl)amino]ethyl ester hydrochloride
OPENEYE Name: 2-[methyl(2-thiocyanatoethyl)amino]ethyl thiocyanate hydrochloride
IUPAC Name: 2-[methyl(2-thiocyanatoethyl)amino]ethyl thiocyanate hydrochloride
SYSTEMATIC NAME: 2-[methyl(2-thiocyanatoethyl)amino]ethyl thiocyanate hydrochloride
MOLECULAR FORMULA: C7H12ClN3S2
MOLECULAR WEIGHT: 237.77328
SMILES: CN(CCSC#N)CCSC#N.Cl
Structure:

CAS RN: 63915-51-5
CAS Name: 1-(3,4-dichlorophenyl)-4-(3-methoxypropyl)piperazine; sulfuric acid
OPENEYE Name: 1-(3,4-dichlorophenyl)-4-(3-methoxypropyl)piperazine; sulfuric acid
IUPAC Name: 1-(3,4-dichlorophenyl)-4-(3-methoxypropyl)piperazine; sulfuric acid
SYSTEMATIC NAME: 1-(3,4-dichlorophenyl)-4-(3-methoxypropyl)piperazine; sulfuric acid
MOLECULAR FORMULA: C14H22Cl2N2O5S
MOLECULAR WEIGHT: 401.30588
SMILES: COCCCN1CCN(CC1)C2=CC(=C(C=C2)Cl)Cl.OS(=O)(=O)O
Structure:

CAS RN: 63915-49-1
CAS Name: 2-(2,4-dichlorophenyl)-3-oxopropanenitrile
OPENEYE Name: 2-(2,4-dichlorophenyl)-3-oxo-propanenitrile
IUPAC Name: 2-(2,4-dichlorophenyl)-3-oxopropanenitrile
SYSTEMATIC NAME: 2-(2,4-dichlorophenyl)-3-oxidanylidene-propanenitrile
MOLECULAR FORMULA: C9H5Cl2NO
MOLECULAR WEIGHT: 214.0481
SMILES: C1=CC(=C(C=C1Cl)Cl)C(C=O)C#N
Structure:

CAS RN: 63915-46-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H32BrNO
MOLECULAR WEIGHT: 430.42098
SMILES: CCC1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=CC=C4)CC)C=C(C=C3)O.Br
Structure:

CAS RN: 63909-08-0
CAS Name: 2-hydroxyacetic acid [2-[4-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] ester hydrochloride
OPENEYE Name: [2-[4-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxo-ethyl] 2-hydroxyacetate hydrochloride
IUPAC Name: [2-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] 2-hydroxyacetate hydrochloride
SYSTEMATIC NAME: [2-[4-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-7-methoxy-2,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-3,4-dihydro-1H-tetracen-2-yl]-2-oxidanylidene-ethyl] 2-oxidanylethanoate hydrochloride
MOLECULAR FORMULA: C29H32ClNO13
MOLECULAR WEIGHT: 638.01628
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)COC(=O)CO)O)N)O.Cl
Structure:

CAS RN: 63908-37-2
CAS Name: 3-(2-methylpropyl)-7H-purine-2,6-dione
OPENEYE Name: 3-isobutyl-7H-purine-2,6-dione
IUPAC Name: 3-(2-methylpropyl)-7H-purine-2,6-dione
SYSTEMATIC NAME: 3-(2-methylpropyl)-7H-purine-2,6-dione
MOLECULAR FORMULA: C9H12N4O2
MOLECULAR WEIGHT: 208.21718
SMILES: CC(C)CN1C2=C(C(=O)NC1=O)NC=N2
Structure:

CAS RN: 63908-24-7
CAS Name: 1,3-bis(2-methylpropyl)-7H-purine-2,6-dione
OPENEYE Name: 1,3-diisobutyl-7H-purine-2,6-dione
IUPAC Name: 1,3-bis(2-methylpropyl)-7H-purine-2,6-dione
SYSTEMATIC NAME: 1,3-bis(2-methylpropyl)-7H-purine-2,6-dione
MOLECULAR FORMULA: C13H20N4O2
MOLECULAR WEIGHT: 264.3235
SMILES: CC(C)CN1C2=C(C(=O)N(C1=O)CC(C)C)NC=N2
Structure:

CAS RN: 63908-22-5
CAS Name: 1-methyl-3-(phenylmethyl)-7H-purine-2,6-dione
OPENEYE Name: 3-benzyl-1-methyl-7H-purine-2,6-dione
IUPAC Name: 3-benzyl-1-methyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 1-methyl-3-(phenylmethyl)-7H-purine-2,6-dione
MOLECULAR FORMULA: C13H12N4O2
MOLECULAR WEIGHT: 256.25998
SMILES: CN1C(=O)C2=C(N=CN2)N(C1=O)CC3=CC=CC=C3
Structure:

CAS RN: 63907-40-4
CAS Name: 1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine; 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine; 5-ethyl-5-phenyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine; 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine; 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C21H28N8O5
MOLECULAR WEIGHT: 472.49762
SMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CN)N
Structure:

CAS RN: 63907-36-8
CAS Name: 1-(8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperidine hydrate tetrahydrochloride
OPENEYE Name: 1-(8-chloro-5-methoxy-tetralin-1-yl)piperidine hydrate tetrahydrochloride
IUPAC Name: 1-(8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperidine hydrate tetrahydrochloride
SYSTEMATIC NAME: 1-(8-chloranyl-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperidine hydrate tetrahydrochloride
MOLECULAR FORMULA: C64H94Cl8N4O5
MOLECULAR WEIGHT: 1283.07896
SMILES: COC1=C2CCCC(C2=C(C=C1)Cl)N3CCCCC3.COC1=C2CCCC(C2=C(C=C1)Cl)N3CCCCC3.COC1=C2CCCC(C2=C(C=C1)Cl)N3CCCCC3.COC1=C2CCCC(C2=C(C=C1)Cl)N3CCCCC3.O.Cl.Cl.Cl.Cl
Structure:

CAS RN: 63907-35-7
CAS Name: 1-phenyl-2-(1-piperidinyl)ethanol hydrochloride
OPENEYE Name: 1-phenyl-2-(1-piperidyl)ethanol hydrochloride
IUPAC Name: 1-phenyl-2-piperidin-1-ylethanol hydrochloride
SYSTEMATIC NAME: 1-phenyl-2-piperidin-1-yl-ethanol hydrochloride
MOLECULAR FORMULA: C13H20ClNO
MOLECULAR WEIGHT: 241.757
SMILES: C1CCN(CC1)CC(C2=CC=CC=C2)O.Cl
Structure:

CAS RN: 63907-32-4
CAS Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; praseodymium(3+)
OPENEYE Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; praseodymium(3+)
IUPAC Name: 2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate; hydron; praseodymium(3+)
SYSTEMATIC NAME: 2-[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate; hydron; praseodymium(3+)
MOLECULAR FORMULA: C10H13N2O8Pr
MOLECULAR WEIGHT: 430.12647
SMILES: [H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Pr+3]
Structure:

CAS RN: 63907-30-2
CAS Name: N-diethoxyphosphoryl-4,5-dimethyl-1,3-dithiolan-2-imine
OPENEYE Name: N-diethoxyphosphoryl-4,5-dimethyl-1,3-dithiolan-2-imine
IUPAC Name: N-diethoxyphosphoryl-4,5-dimethyl-1,3-dithiolan-2-imine
SYSTEMATIC NAME: N-diethoxyphosphoryl-4,5-dimethyl-1,3-dithiolan-2-imine
MOLECULAR FORMULA: C9H18NO3PS2
MOLECULAR WEIGHT: 283.347881
SMILES: CCOP(=O)(N=C1SC(C(S1)C)C)OCC
Structure:

CAS RN: 63907-29-9
CAS Name: 4-imidazo[4,5-d]triazinone
OPENEYE Name: imidazo[4,5-d]triazin-4-one
IUPAC Name: imidazo[4,5-d]triazin-4-one
SYSTEMATIC NAME: imidazo[4,5-d][1,2,3]triazin-4-one
MOLECULAR FORMULA: C4HN5O
MOLECULAR WEIGHT: 135.08364
SMILES: C1=NC2=NN=NC(=O)C2=N1
Structure:

CAS RN: 63907-08-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H26ClN3O3
MOLECULAR WEIGHT: 548.03084
SMILES: C1=CC=C(C=C1)/C(=C/2\C3C=C(C2C4C3C(=O)NC4=O)C(C5=CC=CC=C5)(C6=CC=CC=N6)O)/C7=CC=CC=N7.Cl
Structure:

CAS RN: 63907-05-1
CAS Name: N,2,3-trimethyl-3-bicyclo[2.2.1]heptanamine
OPENEYE Name: N,2,3-trimethylnorbornan-2-amine
IUPAC Name: N,2,3-trimethylbicyclo[2.2.1]heptan-3-amine
SYSTEMATIC NAME: N,2,3-trimethylbicyclo[2.2.1]heptan-3-amine
MOLECULAR FORMULA: C10H19N
MOLECULAR WEIGHT: 153.26456
SMILES: CC1C2CCC(C2)C1(C)NC
Structure:

CAS RN: 63907-04-0
CAS Name: N,N,2,3-tetramethyl-3-bicyclo[2.2.1]heptanamine
OPENEYE Name: N,N,2,3-tetramethylnorbornan-2-amine
IUPAC Name: N,N,2,3-tetramethylbicyclo[2.2.1]heptan-3-amine
SYSTEMATIC NAME: N,N,2,3-tetramethylbicyclo[2.2.1]heptan-3-amine
MOLECULAR FORMULA: C11H21N
MOLECULAR WEIGHT: 167.29114
SMILES: CC1C2CCC(C2)C1(C)N(C)C
Structure:

CAS RN: 63906-94-5
CAS Name: [[oxo(3-pyridinyl)methyl]amino]thiourea hydrochloride
OPENEYE Name: (pyridine-3-carbonylamino)thiourea hydrochloride
IUPAC Name: (pyridine-3-carbonylamino)thiourea hydrochloride
SYSTEMATIC NAME: 1-(pyridin-3-ylcarbonylamino)thiourea hydrochloride
MOLECULAR FORMULA: C7H9ClN4OS
MOLECULAR WEIGHT: 232.69056
SMILES: C1=CC(=CN=C1)C(=O)NNC(=S)N.Cl
Structure:

CAS RN: 63906-93-4
CAS Name: phosphoric acid diethoxyphosphoryl [di(propan-2-yloxy)phosphoryloxy-propan-2-yloxyphosphoryl] ethyl ester
OPENEYE Name: diethoxyphosphoryl [diisopropoxyphosphoryloxy(isopropoxy)phosphoryl] ethyl phosphate
IUPAC Name: diethoxyphosphoryl [di(propan-2-yloxy)phosphoryloxy-propan-2-yloxyphosphoryl] ethyl phosphate
SYSTEMATIC NAME: diethoxyphosphoryl [di(propan-2-yloxy)phosphoryloxy-propan-2-yloxy-phosphoryl] ethyl phosphate
MOLECULAR FORMULA: C15H36O13P4
MOLECULAR WEIGHT: 548.333584
SMILES: CCOP(=O)(OCC)OP(=O)(OCC)OP(=O)(OC(C)C)OP(=O)(OC(C)C)OC(C)C
Structure:

http://ChemLookup.com Compounds

2012-02-27T23:35:00.001-08:00

CAS RN: 63916-29-0
CAS Name: 1-butyl-4-(2-furanyl)-4-piperidinol hydrochloride
OPENEYE Name: 1-butyl-4-(2-furyl)piperidin-4-ol hydrochloride
IUPAC Name: 1-butyl-4-(furan-2-yl)piperidin-4-ol hydrochloride
SYSTEMATIC NAME: 1-butyl-4-(furan-2-yl)piperidin-4-ol hydrochloride
MOLECULAR FORMULA: C13H22ClNO2
MOLECULAR WEIGHT: 259.77228
SMILES: CCCCN1CCC(CC1)(C2=CC=CO2)O.Cl
Structure:

CAS RN: 63916-28-9
CAS Name: propanoic acid (1-butyl-4-cyclohexyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-butyl-4-cyclohexyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (1-butyl-4-cyclohexylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-cyclohexyl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C18H34ClNO2
MOLECULAR WEIGHT: 331.92106
SMILES: CCCCN1CCC(CC1)(C2CCCCC2)OC(=O)CC.Cl
Structure:

CAS RN: 63916-27-8
CAS Name: butanoic acid (1-butyl-4-cyclohexyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-butyl-4-cyclohexyl-4-piperidyl) butanoate hydrochloride
IUPAC Name: (1-butyl-4-cyclohexylpiperidin-4-yl) butanoate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-cyclohexyl-piperidin-4-yl) butanoate hydrochloride
MOLECULAR FORMULA: C19H36ClNO2
MOLECULAR WEIGHT: 345.94764
SMILES: CCCCN1CCC(CC1)(C2CCCCC2)OC(=O)CCC.Cl
Structure:

CAS RN: 63916-26-7
CAS Name: acetic acid (1-butyl-4-cyclohexyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-butyl-4-cyclohexyl-4-piperidyl) acetate hydrochloride
IUPAC Name: (1-butyl-4-cyclohexylpiperidin-4-yl) acetate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-cyclohexyl-piperidin-4-yl) ethanoate hydrochloride
MOLECULAR FORMULA: C17H32ClNO2
MOLECULAR WEIGHT: 317.89448
SMILES: CCCCN1CCC(CC1)(C2CCCCC2)OC(=O)C.Cl
Structure:

CAS RN: 63916-25-6
CAS Name: 1-butyl-3-(1-butyl-4-hydroxy-4-piperidinyl)-4-piperidinone dihydrochloride
OPENEYE Name: 1-butyl-3-(1-butyl-4-hydroxy-4-piperidyl)piperidin-4-one dihydrochloride
IUPAC Name: 1-butyl-3-(1-butyl-4-hydroxypiperidin-4-yl)piperidin-4-one dihydrochloride
SYSTEMATIC NAME: 1-butyl-3-(1-butyl-4-oxidanyl-piperidin-4-yl)piperidin-4-one dihydrochloride
MOLECULAR FORMULA: C18H36Cl2N2O2
MOLECULAR WEIGHT: 383.39664
SMILES: CCCCN1CCC(CC1)(C2CN(CCC2=O)CCCC)O.Cl.Cl
Structure:

CAS RN: 63916-24-5
CAS Name: propanoic acid [4-phenyl-1-(phenylmethyl)-4-piperidinyl] ester hydrochloride
OPENEYE Name: (1-benzyl-4-phenyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (1-benzyl-4-phenylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: [4-phenyl-1-(phenylmethyl)piperidin-4-yl] propanoate hydrochloride
MOLECULAR FORMULA: C21H26ClNO2
MOLECULAR WEIGHT: 359.88964
SMILES: CCC(=O)OC1(CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:

CAS RN: 63916-22-3
CAS Name: 1,1-dimethyl-4-[2-(1-methyl-1-piperidin-1-iumyl)ethyl]piperidin-1-ium diiodide
OPENEYE Name: 1,1-dimethyl-4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
IUPAC Name: 1,1-dimethyl-4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1,1-dimethyl-4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C15H32I2N2
MOLECULAR WEIGHT: 494.23692
SMILES: C[N+]1(CCC(CC1)CC[N+]2(CCCCC2)C)C.[I-].[I-]
Structure:

CAS RN: 63916-21-2
CAS Name: 1-methyl-1-[3-(1-methyl-1-piperidin-1-iumyl)propyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[3-(1-methylpiperidin-1-ium-1-yl)propyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[3-(1-methylpiperidin-1-ium-1-yl)propyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[3-(1-methylpiperidin-1-ium-1-yl)propyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C15H32I2N2
MOLECULAR WEIGHT: 494.23692
SMILES: C[N+]1(CCCCC1)CCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 63916-20-1
CAS Name: carbamodithioic acid; 1-(1-piperidinyl)piperidine
OPENEYE Name: carbamodithioic acid; 1-(1-piperidyl)piperidine
IUPAC Name: carbamodithioic acid; 1-piperidin-1-ylpiperidine
SYSTEMATIC NAME: carbamodithioic acid; 1-piperidin-1-ylpiperidine
MOLECULAR FORMULA: C11H23N3S2
MOLECULAR WEIGHT: 261.45042
SMILES: C1CCN(CC1)N2CCCCC2.C(=S)(N)S
Structure:

CAS RN: 63916-19-8
CAS Name: 1-methyl-1-[2-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]ethyl]piperidin-1-ium diiodide
OPENEYE Name: 1-methyl-1-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium diiodide
IUPAC Name: 1-methyl-1-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium diiodide
SYSTEMATIC NAME: 1-methyl-1-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium diiodide
MOLECULAR FORMULA: C16H34I2N2O
MOLECULAR WEIGHT: 524.2629
SMILES: C[N+]1(CCCCC1)CCOCC[N+]2(CCCCC2)C.[I-].[I-]
Structure:

CAS RN: 63916-18-7
CAS Name: 1-ethyl-1-[2-[2-(1-ethyl-1-piperidin-1-iumyl)ethoxy]ethyl]piperidin-1-ium dibromide
OPENEYE Name: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium dibromide
IUPAC Name: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium dibromide
SYSTEMATIC NAME: 1-ethyl-1-[2-[2-(1-ethylpiperidin-1-ium-1-yl)ethoxy]ethyl]piperidin-1-ium dibromide
MOLECULAR FORMULA: C18H38Br2N2O
MOLECULAR WEIGHT: 458.31512
SMILES: CC[N+]1(CCCCC1)CCOCC[N+]2(CCCCC2)CC.[Br-].[Br-]
Structure:

CAS RN: 63916-17-6
CAS Name: trimethyl-[2-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]ethyl]ammonium diiodide
OPENEYE Name: trimethyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]ammonium diiodide
IUPAC Name: trimethyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
SYSTEMATIC NAME: trimethyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]ethyl]azanium diiodide
MOLECULAR FORMULA: C13H30I2N2O
MOLECULAR WEIGHT: 484.19904
SMILES: C[N+]1(CCCCC1)CCOCC[N+](C)(C)C.[I-].[I-]
Structure:

CAS RN: 63916-16-5
CAS Name: methyl sulfate; 10-pyrido[3,2-b][1,4]benzothiazinecarboxylic acid 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester
OPENEYE Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate; methyl sulfate
IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate; methyl sulfate
SYSTEMATIC NAME: 2-(1-methylpiperidin-1-ium-1-yl)ethyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate; methyl sulfate
MOLECULAR FORMULA: C21H27N3O6S2
MOLECULAR WEIGHT: 481.58558
SMILES: C[N+]1(CCCCC1)CCOC(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.COS(=O)(=O)[O-]
Structure:

CAS RN: 63916-14-3
CAS Name: dimethyl-[2-(1-methyl-1-propyl-4-piperidin-1-iumyl)ethyl]-propylammonium diiodide
OPENEYE Name: dimethyl-[2-(1-methyl-1-propyl-piperidin-1-ium-4-yl)ethyl]-propyl-ammonium diiodide
IUPAC Name: dimethyl-[2-(1-methyl-1-propylpiperidin-1-ium-4-yl)ethyl]-propylazanium diiodide
SYSTEMATIC NAME: dimethyl-[2-(1-methyl-1-propyl-piperidin-1-ium-4-yl)ethyl]-propyl-azanium diiodide
MOLECULAR FORMULA: C16H36I2N2
MOLECULAR WEIGHT: 510.27938
SMILES: CCC[N+]1(CCC(CC1)CC[N+](C)(C)CCC)C.[I-].[I-]
Structure:

CAS RN: 63916-10-9
CAS Name: 2-aminooxypropanoic acid hydrobromide
OPENEYE Name: 2-aminooxypropanoic acid hydrobromide
IUPAC Name: 2-aminooxypropanoic acid hydrobromide
SYSTEMATIC NAME: 2-azanyloxypropanoic acid hydrobromide
MOLECULAR FORMULA: C3H8BrNO3
MOLECULAR WEIGHT: 186.00452
SMILES: CC(C(=O)O)ON.Br
Structure:

CAS RN: 63916-08-5
CAS Name: 3-(carbamimidoylthio)propanoic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 3-carbamimidoylsulfanylpropanoate hydrochloride
IUPAC Name: ethyl 3-carbamimidoylsulfanylpropanoate hydrochloride
SYSTEMATIC NAME: ethyl 3-carbamimidoylsulfanylpropanoate hydrochloride
MOLECULAR FORMULA: C6H13ClN2O2S
MOLECULAR WEIGHT: 212.69762
SMILES: CCOC(=O)CCSC(=N)N.Cl
Structure:

CAS RN: 63916-07-4
CAS Name: 1-[4-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-1-naphthalenyl]-1-propanone dihydrochloride
OPENEYE Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-1-naphthyl]propan-1-one dihydrochloride
IUPAC Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-1-yl]propan-1-one dihydrochloride
SYSTEMATIC NAME: 1-[4-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-1-yl]propan-1-one dihydrochloride
MOLECULAR FORMULA: C26H32Cl2N2O3
MOLECULAR WEIGHT: 491.44988
SMILES: CCC(=O)C1=CC=C(C2=CC=CC=C21)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl
Structure:

CAS RN: 63916-06-3
CAS Name: oxalic acid; N-phenyl-N-[2-(4-phenyl-1-piperidinyl)propyl]propanamide
OPENEYE Name: oxalic acid; N-phenyl-N-[2-(4-phenyl-1-piperidyl)propyl]propanamide
IUPAC Name: oxalic acid; N-phenyl-N-[2-(4-phenylpiperidin-1-yl)propyl]propanamide
SYSTEMATIC NAME: ethanedioic acid; N-phenyl-N-[2-(4-phenylpiperidin-1-yl)propyl]propanamide
MOLECULAR FORMULA: C48H62N4O6
MOLECULAR WEIGHT: 791.02908
SMILES: CCC(=O)N(CC(C)N1CCC(CC1)C2=CC=CC=C2)C3=CC=CC=C3.CCC(=O)N(CC(C)N1CCC(CC1)C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63916-05-2
CAS Name: oxalic acid; N-phenyl-N-[1-(4-phenyl-1-piperidinyl)propan-2-yl]propanamide
OPENEYE Name: N-[1-methyl-2-(4-phenyl-1-piperidyl)ethyl]-N-phenyl-propanamide; oxalic acid
IUPAC Name: oxalic acid; N-phenyl-N-[1-(4-phenylpiperidin-1-yl)propan-2-yl]propanamide
SYSTEMATIC NAME: ethanedioic acid; N-phenyl-N-[1-(4-phenylpiperidin-1-yl)propan-2-yl]propanamide
MOLECULAR FORMULA: C48H62N4O6
MOLECULAR WEIGHT: 791.02908
SMILES: CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)C3=CC=CC=C3.CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63916-04-1
CAS Name: oxalic acid; N-phenyl-N-[1-(4-phenyl-1-piperazinyl)propan-2-yl]propanamide
OPENEYE Name: N-[1-methyl-2-(4-phenylpiperazin-1-yl)ethyl]-N-phenyl-propanamide; oxalic acid
IUPAC Name: oxalic acid; N-phenyl-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]propanamide
SYSTEMATIC NAME: ethanedioic acid; N-phenyl-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]propanamide
MOLECULAR FORMULA: C46H60N6O6
MOLECULAR WEIGHT: 793.0052
SMILES: CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCN(CC2)C3=CC=CC=C3.CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCN(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63916-03-0
CAS Name: N-[(3R,4S)-3-methyl-1-(2-phenylethyl)-4-piperidinyl]-N-phenylpropanamide; nitric acid; 1-propanol
OPENEYE Name: N-[(3R,4S)-3-methyl-1-(2-phenylethyl)-4-piperidyl]-N-phenyl-propanamide; nitric acid; propan-1-ol
IUPAC Name: N-[(3R,4S)-3-methyl-1-(2-phenylethyl)piperidin-4-yl]-N-phenylpropanamide; nitric acid; propan-1-ol
SYSTEMATIC NAME: N-[(3R,4S)-3-methyl-1-(2-phenylethyl)piperidin-4-yl]-N-phenyl-propanamide; nitric acid; propan-1-ol
MOLECULAR FORMULA: C26H39N3O5
MOLECULAR WEIGHT: 473.60496
SMILES: CCCO.CCC(=O)N([C@H]1CCN(C[C@H]1C)CCC2=CC=CC=C2)C3=CC=CC=C3.[N+](=O)(O)[O-]
Structure:

CAS RN: 63916-01-8
CAS Name: N-[1-(4-hydroxy-4-phenyl-1-piperidinyl)propan-2-yl]-N-phenylpropanamide; oxalic acid
OPENEYE Name: N-[2-(4-hydroxy-4-phenyl-1-piperidyl)-1-methyl-ethyl]-N-phenyl-propanamide; oxalic acid
IUPAC Name: N-[1-(4-hydroxy-4-phenylpiperidin-1-yl)propan-2-yl]-N-phenylpropanamide; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; N-[1-(4-oxidanyl-4-phenyl-piperidin-1-yl)propan-2-yl]-N-phenyl-propanamide
MOLECULAR FORMULA: C48H62N4O8
MOLECULAR WEIGHT: 823.02788
SMILES: CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)(C3=CC=CC=C3)O.CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)(C3=CC=CC=C3)O.C(=O)(C(=O)O)O
Structure:

CAS RN: 63916-00-7
CAS Name: 2-nitro-N-(4-nitrophenyl)propanamide
OPENEYE Name: 2-nitro-N-(4-nitrophenyl)propanamide
IUPAC Name: 2-nitro-N-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: 2-nitro-N-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C9H9N3O5
MOLECULAR WEIGHT: 239.18486
SMILES: CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 63915-98-0
CAS Name: 3-[(3-amino-3-oxopropyl)trisulfanyl]propanamide
OPENEYE Name: 3-[(3-amino-3-oxo-propyl)trisulfanyl]propanamide
IUPAC Name: 3-[(3-amino-3-oxopropyl)trisulfanyl]propanamide
SYSTEMATIC NAME: 3-[(3-azanyl-3-oxidanylidene-propyl)trisulfanyl]propanamide
MOLECULAR FORMULA: C6H12N2O2S3
MOLECULAR WEIGHT: 240.36668
SMILES: C(CSSSCCC(=O)N)C(=O)N
Structure:

CAS RN: 63915-96-8
CAS Name: 2-methyl-2-(propan-2-ylthio)propanamide
OPENEYE Name: 2-isopropylsulfanyl-2-methyl-propanamide
IUPAC Name: 2-methyl-2-propan-2-ylsulfanylpropanamide
SYSTEMATIC NAME: 2-methyl-2-propan-2-ylsulfanyl-propanamide
MOLECULAR FORMULA: C7H15NOS
MOLECULAR WEIGHT: 161.2651
SMILES: CC(C)SC(C)(C)C(=O)N
Structure:

CAS RN: 63915-95-7
CAS Name: 2-(butylthio)-2-methylpropanamide
OPENEYE Name: 2-butylsulfanyl-2-methyl-propanamide
IUPAC Name: 2-butylsulfanyl-2-methylpropanamide
SYSTEMATIC NAME: 2-butylsulfanyl-2-methyl-propanamide
MOLECULAR FORMULA: C8H17NOS
MOLECULAR WEIGHT: 175.29168
SMILES: CCCCSC(C)(C)C(=O)N
Structure:

CAS RN: 63915-93-5
CAS Name: oxalic acid; N-(phenylmethyl)-N-[2-(4-phenyl-1-piperidinyl)propyl]propanamide
OPENEYE Name: N-benzyl-N-[2-(4-phenyl-1-piperidyl)propyl]propanamide; oxalic acid
IUPAC Name: N-benzyl-N-[2-(4-phenylpiperidin-1-yl)propyl]propanamide; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; N-(phenylmethyl)-N-[2-(4-phenylpiperidin-1-yl)propyl]propanamide
MOLECULAR FORMULA: C50H66N4O6
MOLECULAR WEIGHT: 819.08224
SMILES: CCC(=O)N(CC1=CC=CC=C1)CC(C)N2CCC(CC2)C3=CC=CC=C3.CCC(=O)N(CC1=CC=CC=C1)CC(C)N2CCC(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63915-92-4
CAS Name: oxalic acid; N-(phenylmethyl)-N-[1-(4-phenyl-1-piperidinyl)propan-2-yl]propanamide
OPENEYE Name: N-benzyl-N-[1-methyl-2-(4-phenyl-1-piperidyl)ethyl]propanamide; oxalic acid
IUPAC Name: N-benzyl-N-[1-(4-phenylpiperidin-1-yl)propan-2-yl]propanamide; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; N-(phenylmethyl)-N-[1-(4-phenylpiperidin-1-yl)propan-2-yl]propanamide
MOLECULAR FORMULA: C50H66N4O6
MOLECULAR WEIGHT: 819.08224
SMILES: CCC(=O)N(CC1=CC=CC=C1)C(C)CN2CCC(CC2)C3=CC=CC=C3.CCC(=O)N(CC1=CC=CC=C1)C(C)CN2CCC(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:

CAS RN: 63915-91-3
CAS Name: N-[2-(4-hydroxy-4-phenyl-1-piperidinyl)propyl]-N-(phenylmethyl)propanamide; oxalic acid
OPENEYE Name: N-benzyl-N-[2-(4-hydroxy-4-phenyl-1-piperidyl)propyl]propanamide; oxalic acid
IUPAC Name: N-benzyl-N-[2-(4-hydroxy-4-phenylpiperidin-1-yl)propyl]propanamide; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; N-[2-(4-oxidanyl-4-phenyl-piperidin-1-yl)propyl]-N-(phenylmethyl)propanamide
MOLECULAR FORMULA: C50H66N4O8
MOLECULAR WEIGHT: 851.08104
SMILES: CCC(=O)N(CC1=CC=CC=C1)CC(C)N2CCC(CC2)(C3=CC=CC=C3)O.CCC(=O)N(CC1=CC=CC=C1)CC(C)N2CCC(CC2)(C3=CC=CC=C3)O.C(=O)(C(=O)O)O
Structure:

CAS RN: 63915-86-6
CAS Name: 3,3-bis(4-chlorophenyl)-N-methyl-2-propen-1-amine; oxalic acid
OPENEYE Name: 3,3-bis(4-chlorophenyl)-N-methyl-prop-2-en-1-amine; oxalic acid
IUPAC Name: 3,3-bis(4-chlorophenyl)-N-methylprop-2-en-1-amine; oxalic acid
SYSTEMATIC NAME: 3,3-bis(4-chlorophenyl)-N-methyl-prop-2-en-1-amine; ethanedioic acid
MOLECULAR FORMULA: C34H32Cl4N2O4
MOLECULAR WEIGHT: 674.44088
SMILES: CNCC=C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl.CNCC=C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O
Structure:

CAS RN: 63915-85-5
CAS Name: 3-(1,9-dimethyl-2-pyrido[3,4-b]indol-2-iumyl)propyl-trimethylammonium dibromide
OPENEYE Name: 3-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)propyl-trimethyl-ammonium dibromide
IUPAC Name: 3-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)propyl-trimethylazanium dibromide
SYSTEMATIC NAME: 3-(1,9-dimethylpyrido[3,4-b]indol-2-ium-2-yl)propyl-trimethyl-azanium dibromide
MOLECULAR FORMULA: C19H27Br2N3
MOLECULAR WEIGHT: 457.24578
SMILES: CC1=[N+](C=CC2=C1N(C3=CC=CC=C23)C)CCC[N+](C)(C)C.[Br-].[Br-]
Structure:

CAS RN: 63915-83-3
CAS Name: N-methyl-N-(4-methyl-1-piperazinyl)-10-pyrido[3,2-b][1,4]benzothiazinecarboxamide hydrochloride
OPENEYE Name: N-methyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
IUPAC Name: N-methyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
SYSTEMATIC NAME: N-methyl-N-(4-methylpiperazin-1-yl)pyrido[3,2-b][1,4]benzothiazine-10-carboxamide hydrochloride
MOLECULAR FORMULA: C18H22ClN5OS
MOLECULAR WEIGHT: 391.91818
SMILES: CN1CCN(CC1)N(C)C(=O)N2C3=CC=CC=C3SC4=C2N=CC=C4.Cl
Structure:

CAS RN: 63915-82-2
CAS Name: 1-methyl-1-[[4-[(1-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]piperidin-1-ium dibromide
OPENEYE Name: 1-methyl-1-[[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]piperidin-1-ium dibromide
IUPAC Name: 1-methyl-1-[[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]piperidin-1-ium dibromide
SYSTEMATIC NAME: 1-methyl-1-[[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]piperidin-1-ium dibromide
MOLECULAR FORMULA: C20H34Br2N2
MOLECULAR WEIGHT: 462.30536
SMILES: C[N+]1(CCCCC1)CC2=CC=C(C=C2)C[N+]3(CCCCC3)C.[Br-].[Br-]
Structure:

CAS RN: 63915-81-1
CAS Name: 1-[4-methoxy-8-(1-pyrrolidinyl)-5,6,7,8-tetrahydronaphthalen-1-yl]-1-pentanone hydrochloride
OPENEYE Name: 1-(8-methoxy-4-pyrrolidin-1-yl-tetralin-5-yl)pentan-1-one hydrochloride
IUPAC Name: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)pentan-1-one hydrochloride
SYSTEMATIC NAME: 1-(4-methoxy-8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)pentan-1-one hydrochloride
MOLECULAR FORMULA: C20H30ClNO2
MOLECULAR WEIGHT: 351.9107
SMILES: CCCCC(=O)C1=C2C(CCCC2=C(C=C1)OC)N3CCCC3.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-27T22:35:00.001-08:00

CAS RN: 63916-49-4
CAS Name: acetic acid (1,4-dibutyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1,4-dibutyl-4-piperidyl) acetate hydrochloride
IUPAC Name: (1,4-dibutylpiperidin-4-yl) acetate hydrochloride
SYSTEMATIC NAME: (1,4-dibutylpiperidin-4-yl) ethanoate hydrochloride
MOLECULAR FORMULA: C15H30ClNO2
MOLECULAR WEIGHT: 291.8572
SMILES: CCCCC1(CCN(CC1)CCCC)OC(=O)C.Cl
Structure:

CAS RN: 63916-48-3
CAS Name: propanoic acid (4-cyclohexyl-1-methyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (4-cyclohexyl-1-methyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (4-cyclohexyl-1-methylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (4-cyclohexyl-1-methyl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C15H28ClNO2
MOLECULAR WEIGHT: 289.84132
SMILES: CCC(=O)OC1(CCN(CC1)C)C2CCCCC2.Cl
Structure:

CAS RN: 63916-47-2
CAS Name: propanoic acid (4-cyclohexyl-1-propan-2-yl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (4-cyclohexyl-1-isopropyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (4-cyclohexyl-1-propan-2-ylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (4-cyclohexyl-1-propan-2-yl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C17H32ClNO2
MOLECULAR WEIGHT: 317.89448
SMILES: CCC(=O)OC1(CCN(CC1)C(C)C)C2CCCCC2.Cl
Structure:

CAS RN: 63916-46-1
CAS Name: propanoic acid (4-cyclohexyl-1,3-dimethyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (4-cyclohexyl-1,3-dimethyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (4-cyclohexyl-1,3-dimethylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (4-cyclohexyl-1,3-dimethyl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C16H30ClNO2
MOLECULAR WEIGHT: 303.8679
SMILES: CCC(=O)OC1(CCN(CC1C)C)C2CCCCC2.Cl
Structure:

CAS RN: 63916-45-0
CAS Name: propanoic acid [1-butyl-4-(3-methylphenyl)-4-piperidinyl] ester hydrochloride
OPENEYE Name: [1-butyl-4-(m-tolyl)-4-piperidyl] propanoate hydrochloride
IUPAC Name: [1-butyl-4-(3-methylphenyl)piperidin-4-yl] propanoate hydrochloride
SYSTEMATIC NAME: [1-butyl-4-(3-methylphenyl)piperidin-4-yl] propanoate hydrochloride
MOLECULAR FORMULA: C19H30ClNO2
MOLECULAR WEIGHT: 339.9
SMILES: CCCCN1CCC(CC1)(C2=CC(=CC=C2)C)OC(=O)CC.Cl
Structure:

CAS RN: 63916-44-9
CAS Name: propanoic acid (1-butyl-4-thiophen-2-yl-4-piperidinyl) ester hydrochloride
OPENEYE Name: [1-butyl-4-(2-thienyl)-4-piperidyl] propanoate hydrochloride
IUPAC Name: (1-butyl-4-thiophen-2-ylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-thiophen-2-yl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C16H26ClNO2S
MOLECULAR WEIGHT: 331.90114
SMILES: CCCCN1CCC(CC1)(C2=CC=CS2)OC(=O)CC.Cl
Structure:

CAS RN: 63916-43-8
CAS Name: 1-butyl-4-thiophen-2-yl-4-piperidinol hydrochloride
OPENEYE Name: 1-butyl-4-(2-thienyl)piperidin-4-ol hydrochloride
IUPAC Name: 1-butyl-4-thiophen-2-ylpiperidin-4-ol hydrochloride
SYSTEMATIC NAME: 1-butyl-4-thiophen-2-yl-piperidin-4-ol hydrochloride
MOLECULAR FORMULA: C13H22ClNOS
MOLECULAR WEIGHT: 275.83788
SMILES: CCCCN1CCC(CC1)(C2=CC=CS2)O.Cl
Structure:

CAS RN: 63916-42-7
CAS Name: propanoic acid [1-butyl-4-(3-pyridinyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(3-pyridyl)-4-piperidyl] propanoate dihydrochloride
IUPAC Name: (1-butyl-4-pyridin-3-ylpiperidin-4-yl) propanoate dihydrochloride
SYSTEMATIC NAME: (1-butyl-4-pyridin-3-yl-piperidin-4-yl) propanoate dihydrochloride
MOLECULAR FORMULA: C17H28Cl2N2O2
MOLECULAR WEIGHT: 363.32242
SMILES: CCCCN1CCC(CC1)(C2=CN=CC=C2)OC(=O)CC.Cl.Cl
Structure:

CAS RN: 63916-41-6
CAS Name: propanoic acid [1-butyl-4-(2-pyridinyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(2-pyridyl)-4-piperidyl] propanoate dihydrochloride
IUPAC Name: (1-butyl-4-pyridin-2-ylpiperidin-4-yl) propanoate dihydrochloride
SYSTEMATIC NAME: (1-butyl-4-pyridin-2-yl-piperidin-4-yl) propanoate dihydrochloride
MOLECULAR FORMULA: C17H28Cl2N2O2
MOLECULAR WEIGHT: 363.32242
SMILES: CCCCN1CCC(CC1)(C2=CC=CC=N2)OC(=O)CC.Cl.Cl
Structure:

CAS RN: 63916-40-5
CAS Name: propanoic acid [1-butyl-4-(2-pyridinylmethyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(2-pyridylmethyl)-4-piperidyl] propanoate dihydrochloride
IUPAC Name: [1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-yl] propanoate dihydrochloride
SYSTEMATIC NAME: [1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-yl] propanoate dihydrochloride
MOLECULAR FORMULA: C18H30Cl2N2O2
MOLECULAR WEIGHT: 377.349
SMILES: CCCCN1CCC(CC1)(CC2=CC=CC=N2)OC(=O)CC.Cl.Cl
Structure:

CAS RN: 63916-39-2
CAS Name: 1-butyl-4-(2-pyridinylmethyl)-4-piperidinol dihydrochloride
OPENEYE Name: 1-butyl-4-(2-pyridylmethyl)piperidin-4-ol dihydrochloride
IUPAC Name: 1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-ol dihydrochloride
SYSTEMATIC NAME: 1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-ol dihydrochloride
MOLECULAR FORMULA: C15H26Cl2N2O
MOLECULAR WEIGHT: 321.28574
SMILES: CCCCN1CCC(CC1)(CC2=CC=CC=N2)O.Cl.Cl
Structure:

CAS RN: 63916-38-1
CAS Name: acetic acid [1-butyl-4-(2-pyridinylmethyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(2-pyridylmethyl)-4-piperidyl] acetate dihydrochloride
IUPAC Name: [1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-yl] acetate dihydrochloride
SYSTEMATIC NAME: [1-butyl-4-(pyridin-2-ylmethyl)piperidin-4-yl] ethanoate dihydrochloride
MOLECULAR FORMULA: C17H28Cl2N2O2
MOLECULAR WEIGHT: 363.32242
SMILES: CCCCN1CCC(CC1)(CC2=CC=CC=N2)OC(=O)C.Cl.Cl
Structure:

CAS RN: 63916-37-0
CAS Name: butanoic acid [1-butyl-4-(3-pyridinyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(3-pyridyl)-4-piperidyl] butanoate dihydrochloride
IUPAC Name: (1-butyl-4-pyridin-3-ylpiperidin-4-yl) butanoate dihydrochloride
SYSTEMATIC NAME: (1-butyl-4-pyridin-3-yl-piperidin-4-yl) butanoate dihydrochloride
MOLECULAR FORMULA: C18H30Cl2N2O2
MOLECULAR WEIGHT: 377.349
SMILES: CCCCN1CCC(CC1)(C2=CN=CC=C2)OC(=O)CCC.Cl.Cl
Structure:

CAS RN: 63916-36-9
CAS Name: acetic acid [1-butyl-4-(3-pyridinyl)-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-(3-pyridyl)-4-piperidyl] acetate dihydrochloride
IUPAC Name: (1-butyl-4-pyridin-3-ylpiperidin-4-yl) acetate dihydrochloride
SYSTEMATIC NAME: (1-butyl-4-pyridin-3-yl-piperidin-4-yl) ethanoate dihydrochloride
MOLECULAR FORMULA: C16H26Cl2N2O2
MOLECULAR WEIGHT: 349.29584
SMILES: CCCCN1CCC(CC1)(C2=CN=CC=C2)OC(=O)C.Cl.Cl
Structure:

CAS RN: 63916-35-8
CAS Name: propanoic acid [1-butyl-4-[(6-methyl-2-pyridinyl)methyl]-4-piperidinyl] ester dihydrochloride
OPENEYE Name: [1-butyl-4-[(6-methyl-2-pyridyl)methyl]-4-piperidyl] propanoate dihydrochloride
IUPAC Name: [1-butyl-4-[(6-methylpyridin-2-yl)methyl]piperidin-4-yl] propanoate dihydrochloride
SYSTEMATIC NAME: [1-butyl-4-[(6-methylpyridin-2-yl)methyl]piperidin-4-yl] propanoate dihydrochloride
MOLECULAR FORMULA: C19H32Cl2N2O2
MOLECULAR WEIGHT: 391.37558
SMILES: CCCCN1CCC(CC1)(CC2=CC=CC(=N2)C)OC(=O)CC.Cl.Cl
Structure:

CAS RN: 63916-34-7
CAS Name: propanoic acid (1-butan-2-yl-4-phenyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (4-phenyl-1-sec-butyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (1-butan-2-yl-4-phenylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (1-butan-2-yl-4-phenyl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C18H28ClNO2
MOLECULAR WEIGHT: 325.87342
SMILES: CCC(C)N1CCC(CC1)(C2=CC=CC=C2)OC(=O)CC.Cl
Structure:

CAS RN: 63916-33-6
CAS Name: 2-phenylacetic acid (1-butyl-4-phenyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-butyl-4-phenyl-4-piperidyl) 2-phenylacetate hydrochloride
IUPAC Name: (1-butyl-4-phenylpiperidin-4-yl) 2-phenylacetate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-phenyl-piperidin-4-yl) 2-phenylethanoate hydrochloride
MOLECULAR FORMULA: C23H30ClNO2
MOLECULAR WEIGHT: 387.9428
SMILES: CCCCN1CCC(CC1)(C2=CC=CC=C2)OC(=O)CC3=CC=CC=C3.Cl
Structure:

CAS RN: 63916-32-5
CAS Name: propanoic acid (1-butyl-1-oxido-4-phenyl-4-piperidin-1-iumyl) ester
OPENEYE Name: (1-butyl-1-oxido-4-phenyl-piperidin-1-ium-4-yl) propanoate
IUPAC Name: (1-butyl-1-oxido-4-phenylpiperidin-1-ium-4-yl) propanoate
SYSTEMATIC NAME: (1-butyl-1-oxidanidyl-4-phenyl-piperidin-1-ium-4-yl) propanoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: CCCC[N+]1(CCC(CC1)(C2=CC=CC=C2)OC(=O)CC)[O-]
Structure:

CAS RN: 63916-31-4
CAS Name: propanoic acid (1-butyl-4-methyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-butyl-4-methyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (1-butyl-4-methylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (1-butyl-4-methyl-piperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C13H26ClNO2
MOLECULAR WEIGHT: 263.80404
SMILES: CCCCN1CCC(CC1)(C)OC(=O)CC.Cl
Structure:

CAS RN: 63916-30-3
CAS Name: propanoic acid [1-butyl-4-(2-furanyl)-4-piperidinyl] ester hydrochloride
OPENEYE Name: [1-butyl-4-(2-furyl)-4-piperidyl] propanoate hydrochloride
IUPAC Name: [1-butyl-4-(furan-2-yl)piperidin-4-yl] propanoate hydrochloride
SYSTEMATIC NAME: [1-butyl-4-(furan-2-yl)piperidin-4-yl] propanoate hydrochloride
MOLECULAR FORMULA: C16H26ClNO3
MOLECULAR WEIGHT: 315.83554
SMILES: CCCCN1CCC(CC1)(C2=CC=CO2)OC(=O)CC.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-27T21:37:00.001-08:00

CAS RN: 63917-54-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H26N2O2
MOLECULAR WEIGHT: 350.45404
SMILES: COC1=CC2=C(CCC3=C(C2OC4CC5CCC(C4)N5)C=CC=N3)C=C1
Structure:

CAS RN: 63917-42-0
CAS Name: 3-[4-chloro-2-[(4-chlorophenyl)thio]phenyl]-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: 3-[4-chloro-2-(4-chlorophenyl)sulfanyl-phenyl]-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: 3-[4-chloro-2-(4-chlorophenyl)sulfanylphenyl]-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: 3-[4-chloranyl-2-(4-chlorophenyl)sulfanyl-phenyl]-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C17H20Cl3NS
MOLECULAR WEIGHT: 376.7714
SMILES: CN(C)CCCC1=C(C=C(C=C1)Cl)SC2=CC=C(C=C2)Cl.Cl
Structure:

CAS RN: 63917-40-8
CAS Name: 1,2,3,4,5,6-hexamethyl-1,3,5,2,4,6-triphosphatriborinane
OPENEYE Name: 1,2,3,4,5,6-hexamethyl-1,3,5,2,4,6-triphosphatriborinane
IUPAC Name: 1,2,3,4,5,6-hexamethyl-1,3,5,2,4,6-triphosphatriborinane
SYSTEMATIC NAME: 1,2,3,4,5,6-hexamethyl-1,3,5,2,4,6-triphosphatriborinane
MOLECULAR FORMULA: C6H18B3P3
MOLECULAR WEIGHT: 215.561403
SMILES: B1(P(B(P(B(P1C)C)C)C)C)C
Structure:

CAS RN: 63917-38-4
CAS Name: 4-[[2-[1,4-dimethyl-4-[2-[(4-methyl-4-morpholin-4-iumyl)methylthio]ethyl]-1-piperazine-1,4-diiumyl]ethylthio]methyl]-4-methylmorpholin-4-ium; 4-methylbenzenesulfonate
OPENEYE Name: 4-[2-[1,4-dimethyl-4-[2-[(4-methylmorpholin-4-ium-4-yl)methylsulfanyl]ethyl]piperazine-1,4-diium-1-yl]ethylsulfanylmethyl]-4-methyl-morpholin-4-ium; 4-methylbenzenesulfonate
IUPAC Name: 4-[2-[1,4-dimethyl-4-[2-[(4-methylmorpholin-4-ium-4-yl)methylsulfanyl]ethyl]piperazine-1,4-diium-1-yl]ethylsulfanylmethyl]-4-methylmorpholin-4-ium; 4-methylbenzenesulfonate
SYSTEMATIC NAME: 4-[2-[1,4-dimethyl-4-[2-[(4-methylmorpholin-4-ium-4-yl)methylsulfanyl]ethyl]piperazine-1,4-diium-1-yl]ethylsulfanylmethyl]-4-methyl-morpholin-4-ium; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C50H76N4O14S6
MOLECULAR WEIGHT: 1149.54684
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CC[N+](CC1)(C)CCSC[N+]2(CCOCC2)C)CCSC[N+]3(CCOCC3)C
Structure:

CAS RN: 63917-35-1
CAS Name: N-[4-chloro-2-[(4-chlorophenyl)thio]phenyl]-3-(dimethylamino)propanamide
OPENEYE Name: N-[4-chloro-2-(4-chlorophenyl)sulfanyl-phenyl]-3-(dimethylamino)propanamide
IUPAC Name: N-[4-chloro-2-(4-chlorophenyl)sulfanylphenyl]-3-(dimethylamino)propanamide
SYSTEMATIC NAME: N-[4-chloranyl-2-(4-chlorophenyl)sulfanyl-phenyl]-3-(dimethylamino)propanamide
MOLECULAR FORMULA: C17H18Cl2N2OS
MOLECULAR WEIGHT: 369.30862
SMILES: CN(C)CCC(=O)NC1=C(C=C(C=C1)Cl)SC2=CC=C(C=C2)Cl
Structure:

CAS RN: 63917-34-0
CAS Name: 8-[2-(dimethylamino)ethoxy]-1,3-dimethyl-7H-purine-2,6-dione
OPENEYE Name: 8-[2-(dimethylamino)ethoxy]-1,3-dimethyl-7H-purine-2,6-dione
IUPAC Name: 8-[2-(dimethylamino)ethoxy]-1,3-dimethyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 8-[2-(dimethylamino)ethoxy]-1,3-dimethyl-7H-purine-2,6-dione
MOLECULAR FORMULA: C11H17N5O3
MOLECULAR WEIGHT: 267.28438
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)OCCN(C)C
Structure:

CAS RN: 63917-33-9
CAS Name: [4-[2-(dimethylamino)ethoxy]-3,5-dimethoxyphenyl]-(4-morpholinyl)methanone hydrochloride
OPENEYE Name: [4-[2-(dimethylamino)ethoxy]-3,5-dimethoxy-phenyl]-morpholino-methanone hydrochloride
IUPAC Name: [4-[2-(dimethylamino)ethoxy]-3,5-dimethoxyphenyl]-morpholin-4-ylmethanone hydrochloride
SYSTEMATIC NAME: [4-[2-(dimethylamino)ethoxy]-3,5-dimethoxy-phenyl]-morpholin-4-yl-methanone hydrochloride
MOLECULAR FORMULA: C17H27ClN2O5
MOLECULAR WEIGHT: 374.85968
SMILES: CN(C)CCOC1=C(C=C(C=C1OC)C(=O)N2CCOCC2)OC.Cl
Structure:

CAS RN: 63917-28-2
CAS Name: 4-phenyl-3,4-dihydro-1H-quinazoline-2-thione
OPENEYE Name: 4-phenyl-3,4-dihydro-1H-quinazoline-2-thione
IUPAC Name: 4-phenyl-3,4-dihydro-1H-quinazoline-2-thione
SYSTEMATIC NAME: 4-phenyl-3,4-dihydro-1H-quinazoline-2-thione
MOLECULAR FORMULA: C14H12N2S
MOLECULAR WEIGHT: 240.32348
SMILES: C1=CC=C(C=C1)C2C3=CC=CC=C3NC(=S)N2
Structure:

CAS RN: 63917-27-1
CAS Name: 3-(2-mercaptophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione
OPENEYE Name: 4,6,6-trimethyl-3-(2-sulfanylphenyl)-1H-pyrimidine-2-thione
IUPAC Name: 4,6,6-trimethyl-3-(2-sulfanylphenyl)-1H-pyrimidine-2-thione
SYSTEMATIC NAME: 4,6,6-trimethyl-3-(2-sulfanylphenyl)-1H-pyrimidine-2-thione
MOLECULAR FORMULA: C13H16N2S2
MOLECULAR WEIGHT: 264.40954
SMILES: CC1=CC(NC(=S)N1C2=CC=CC=C2S)(C)C
Structure:

CAS RN: 63917-26-0
CAS Name: 1-[2-(4,5-dihydroimidazol-1-yl)ethyl]-3-[2-(1-imidazolyl)ethyl]thiourea
OPENEYE Name: 1-[2-(4,5-dihydroimidazol-1-yl)ethyl]-3-(2-imidazol-1-ylethyl)thiourea
IUPAC Name: 1-[2-(4,5-dihydroimidazol-1-yl)ethyl]-3-(2-imidazol-1-ylethyl)thiourea
SYSTEMATIC NAME: 1-[2-(4,5-dihydroimidazol-1-yl)ethyl]-3-(2-imidazol-1-ylethyl)thiourea
MOLECULAR FORMULA: C11H18N6S
MOLECULAR WEIGHT: 266.36582
SMILES: C1CN(C=N1)CCNC(=S)NCCN2C=CN=C2
Structure:

CAS RN: 63917-04-4
CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; lutetium(3+)
OPENEYE Name: lutetium(3+) citrate
IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; lutetium(3+)
SYSTEMATIC NAME: lutetium(3+); 2-oxidanylpropane-1,2,3-tricarboxylate
MOLECULAR FORMULA: C6H5LuO7
MOLECULAR WEIGHT: 364.0667
SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Lu+3]
Structure:

CAS RN: 63917-02-2
CAS Name: (2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid ethyl ester hydrochloride
OPENEYE Name: ethyl (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate hydrochloride
IUPAC Name: ethyl (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate hydrochloride
SYSTEMATIC NAME: ethyl (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate hydrochloride
MOLECULAR FORMULA: C21H34Cl3N3O3
MOLECULAR WEIGHT: 482.87196
SMILES: CCOC(=O)[C@H](CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)[C@H](CC(C)C)N.Cl
Structure:

CAS RN: 63917-01-1
CAS Name: dodecanoic acid thiocyanatomethyl ester; thiocyanic acid 2-(2-butoxyethoxy)ethyl ester
OPENEYE Name: 2-(2-butoxyethoxy)ethyl thiocyanate; thiocyanatomethyl dodecanoate
IUPAC Name: 2-(2-butoxyethoxy)ethyl thiocyanate; thiocyanatomethyl dodecanoate
SYSTEMATIC NAME: 2-(2-butoxyethoxy)ethyl thiocyanate; thiocyanatomethyl dodecanoate
MOLECULAR FORMULA: C51H92N4O8S4
MOLECULAR WEIGHT: 1017.55818
SMILES: CCCCCCCCCCCC(=O)OCSC#N.CCCCCCCCCCCC(=O)OCSC#N.CCCCCCCCCCCC(=O)OCSC#N.CCCCOCCOCCSC#N
Structure:

CAS RN: 63916-99-4
CAS Name: 2-(4-methyl-1-quinolin-1-iumyl)acetic acid ethyl ester bromide
OPENEYE Name: ethyl 2-(4-methylquinolin-1-ium-1-yl)acetate bromide
IUPAC Name: ethyl 2-(4-methylquinolin-1-ium-1-yl)acetate bromide
SYSTEMATIC NAME: ethyl 2-(4-methylquinolin-1-ium-1-yl)ethanoate bromide
MOLECULAR FORMULA: C14H16BrNO2
MOLECULAR WEIGHT: 310.18634
SMILES: CCOC(=O)C[N+]1=CC=C(C2=CC=CC=C21)C.[Br-]
Structure:

CAS RN: 63916-96-1
CAS Name: lead(2+) diperchlorate hexahydrate
OPENEYE Name: plumbous diperchlorate hexahydrate
IUPAC Name: lead(2+) diperchlorate hexahydrate
SYSTEMATIC NAME: lead(2+) diperchlorate hexahydrate
MOLECULAR FORMULA: Cl2H12O14Pb
MOLECULAR WEIGHT: 514.19288
SMILES: O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pb+2]
Structure:

CAS RN: 63916-72-3
CAS Name: 4-cyclohexylbenzoic acid 3-(2-methyl-1-piperidinyl)propyl ester
OPENEYE Name: 3-(2-methyl-1-piperidyl)propyl 4-cyclohexylbenzoate
IUPAC Name: 3-(2-methylpiperidin-1-yl)propyl 4-cyclohexylbenzoate
SYSTEMATIC NAME: 3-(2-methylpiperidin-1-yl)propyl 4-cyclohexylbenzoate
MOLECULAR FORMULA: C22H33NO2
MOLECULAR WEIGHT: 343.50292
SMILES: CC1CCCCN1CCCOC(=O)C2=CC=C(C=C2)C3CCCCC3
Structure:

CAS RN: 63916-57-4
CAS Name: 4-chloro-2-[(4-chlorophenyl)thio]-N-[3-(1-piperidinyl)propyl]aniline hydrochloride
OPENEYE Name: 4-chloro-2-(4-chlorophenyl)sulfanyl-N-[3-(1-piperidyl)propyl]aniline hydrochloride
IUPAC Name: 4-chloro-2-(4-chlorophenyl)sulfanyl-N-(3-piperidin-1-ylpropyl)aniline hydrochloride
SYSTEMATIC NAME: 4-chloranyl-2-(4-chlorophenyl)sulfanyl-N-(3-piperidin-1-ylpropyl)aniline hydrochloride
MOLECULAR FORMULA: C20H25Cl3N2S
MOLECULAR WEIGHT: 431.8499
SMILES: C1CCN(CC1)CCCNC2=C(C=C(C=C2)Cl)SC3=CC=C(C=C3)Cl.Cl
Structure:

CAS RN: 63916-56-3
CAS Name: N-[4-chloro-2-[(4-chlorophenyl)thio]phenyl]-3-(1-piperidinyl)propanamide
OPENEYE Name: N-[4-chloro-2-(4-chlorophenyl)sulfanyl-phenyl]-3-(1-piperidyl)propanamide
IUPAC Name: N-[4-chloro-2-(4-chlorophenyl)sulfanylphenyl]-3-piperidin-1-ylpropanamide
SYSTEMATIC NAME: N-[4-chloranyl-2-(4-chlorophenyl)sulfanyl-phenyl]-3-piperidin-1-yl-propanamide
MOLECULAR FORMULA: C20H22Cl2N2OS
MOLECULAR WEIGHT: 409.37248
SMILES: C1CCN(CC1)CCC(=O)NC2=C(C=C(C=C2)Cl)SC3=CC=C(C=C3)Cl
Structure:

CAS RN: 63916-55-2
CAS Name: N-[5-chloro-2-[(4-chlorophenyl)thio]phenyl]-3-(1-piperidinyl)propanamide
OPENEYE Name: N-[5-chloro-2-(4-chlorophenyl)sulfanyl-phenyl]-3-(1-piperidyl)propanamide
IUPAC Name: N-[5-chloro-2-(4-chlorophenyl)sulfanylphenyl]-3-piperidin-1-ylpropanamide
SYSTEMATIC NAME: N-[5-chloranyl-2-(4-chlorophenyl)sulfanyl-phenyl]-3-piperidin-1-yl-propanamide
MOLECULAR FORMULA: C20H22Cl2N2OS
MOLECULAR WEIGHT: 409.37248
SMILES: C1CCN(CC1)CCC(=O)NC2=C(C=CC(=C2)Cl)SC3=CC=C(C=C3)Cl
Structure:

CAS RN: 63916-54-1
CAS Name: 1-(cyclohexylmethyl)piperidine; [(4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
OPENEYE Name: 1-(cyclohexylmethyl)piperidine; [(1S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonic acid
IUPAC Name: 1-(cyclohexylmethyl)piperidine; [(4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
SYSTEMATIC NAME: 1-(cyclohexylmethyl)piperidine; [(4S)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
MOLECULAR FORMULA: C22H39NO4S
MOLECULAR WEIGHT: 413.61436
SMILES: CC1(C2CC[C@]1(C(=O)C2)CS(=O)(=O)O)C.C1CCC(CC1)CN2CCCCC2
Structure:

CAS RN: 63916-53-0
CAS Name: 2,2-diphenylacetic acid (1-methyl-4-phenyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1-methyl-4-phenyl-4-piperidyl) 2,2-diphenylacetate hydrochloride
IUPAC Name: (1-methyl-4-phenylpiperidin-4-yl) 2,2-diphenylacetate hydrochloride
SYSTEMATIC NAME: (1-methyl-4-phenyl-piperidin-4-yl) 2,2-diphenylethanoate hydrochloride
MOLECULAR FORMULA: C26H28ClNO2
MOLECULAR WEIGHT: 421.95902
SMILES: CN1CCC(CC1)(C2=CC=CC=C2)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl
Structure:

CAS RN: 63916-52-9
CAS Name: acetic acid (3-ethyl-1-methyl-4-phenyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (3-ethyl-1-methyl-4-phenyl-4-piperidyl) acetate hydrochloride
IUPAC Name: (3-ethyl-1-methyl-4-phenylpiperidin-4-yl) acetate hydrochloride
SYSTEMATIC NAME: (3-ethyl-1-methyl-4-phenyl-piperidin-4-yl) ethanoate hydrochloride
MOLECULAR FORMULA: C16H24ClNO2
MOLECULAR WEIGHT: 297.82026
SMILES: CCC1CN(CCC1(C2=CC=CC=C2)OC(=O)C)C.Cl
Structure:

CAS RN: 63916-51-8
CAS Name: propanoic acid (1,4-dibutyl-4-piperidinyl) ester hydrochloride
OPENEYE Name: (1,4-dibutyl-4-piperidyl) propanoate hydrochloride
IUPAC Name: (1,4-dibutylpiperidin-4-yl) propanoate hydrochloride
SYSTEMATIC NAME: (1,4-dibutylpiperidin-4-yl) propanoate hydrochloride
MOLECULAR FORMULA: C16H32ClNO2
MOLECULAR WEIGHT: 305.88378
SMILES: CCCCC1(CCN(CC1)CCCC)OC(=O)CC.Cl
Structure:

CAS RN: 63916-50-7
CAS Name: 1,4-dibutyl-4-piperidinol hydrochloride
OPENEYE Name: 1,4-dibutylpiperidin-4-ol hydrochloride
IUPAC Name: 1,4-dibutylpiperidin-4-ol hydrochloride
SYSTEMATIC NAME: 1,4-dibutylpiperidin-4-ol hydrochloride
MOLECULAR FORMULA: C13H28ClNO
MOLECULAR WEIGHT: 249.82052
SMILES: CCCCC1(CCN(CC1)CCCC)O.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-27T20:35:00.001-08:00

CAS RN: 63931-74-8
CAS Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 4-(2,6-dimethylphenyl)-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C16H15N3O
MOLECULAR WEIGHT: 265.3098
SMILES: CC1=C(C(=CC=C1)C)N2C=NNC3=CC=CC=C3C2=O
Structure:

CAS RN: 63931-73-7
CAS Name: 4-(2-methylphenyl)-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 4-(o-tolyl)-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 4-(2-methylphenyl)-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 4-(2-methylphenyl)-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C15H13N3O
MOLECULAR WEIGHT: 251.28322
SMILES: CC1=CC=CC=C1N2C=NNC3=CC=CC=C3C2=O
Structure:

CAS RN: 63931-72-6
CAS Name: 7-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 7-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 7-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 7-chloranyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C14H10ClN3O
MOLECULAR WEIGHT: 271.7017
SMILES: C1=CC=C(C=C1)N2C=NNC3=C(C2=O)C=C(C=C3)Cl
Structure:

CAS RN: 63931-71-5
CAS Name: 8-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 8-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 8-chloro-4-phenyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 8-chloranyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C14H10ClN3O
MOLECULAR WEIGHT: 271.7017
SMILES: C1=CC=C(C=C1)N2C=NNC3=C(C2=O)C=CC(=C3)Cl
Structure:

CAS RN: 63931-69-1
CAS Name: 7-methoxy-4-methyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 7-methoxy-4-methyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 7-methoxy-4-methyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 7-methoxy-4-methyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C10H11N3O2
MOLECULAR WEIGHT: 205.21324
SMILES: CN1C=NNC2=C(C1=O)C=C(C=C2)OC
Structure:

CAS RN: 63931-67-9
CAS Name: 8-chloro-4-methyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 8-chloro-4-methyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 8-chloro-4-methyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 8-chloranyl-4-methyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C9H8ClN3O
MOLECULAR WEIGHT: 209.63232
SMILES: CN1C=NNC2=C(C1=O)C=CC(=C2)Cl
Structure:

CAS RN: 63931-65-7
CAS Name: 4-phenyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 4-phenyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 4-phenyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 4-phenyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C14H11N3O
MOLECULAR WEIGHT: 237.25664
SMILES: C1=CC=C(C=C1)N2C=NNC3=CC=CC=C3C2=O
Structure:

CAS RN: 63931-12-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H9N5OS
MOLECULAR WEIGHT: 247.27636
SMILES: CC1=NC2=C(C=C1)SC3=C(NC(=O)N=C3N2)N
Structure:

CAS RN: 63931-09-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H10N6S
MOLECULAR WEIGHT: 246.2916
SMILES: CC1=NC2=C(C=C1)SC3=C(N2)N=C(N=C3N)N
Structure:

CAS RN: 63927-84-4
CAS Name: 5-(1H-imidazol-2-ylmethyl)-2H-tetrazole
OPENEYE Name: 5-(1H-imidazol-2-ylmethyl)-2H-tetrazole
IUPAC Name: 5-(1H-imidazol-2-ylmethyl)-2H-tetrazole
SYSTEMATIC NAME: 5-(1H-imidazol-2-ylmethyl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C5H6N6
MOLECULAR WEIGHT: 150.14134
SMILES: C1=CN=C(N1)CC2=NNN=N2
Structure:

CAS RN: 63927-73-1
CAS Name: 5-[(1-methyl-2-imidazolyl)methyl]-2H-tetrazole
OPENEYE Name: 5-[(1-methylimidazol-2-yl)methyl]-2H-tetrazole
IUPAC Name: 5-[(1-methylimidazol-2-yl)methyl]-2H-tetrazole
SYSTEMATIC NAME: 5-[(1-methylimidazol-2-yl)methyl]-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C6H8N6
MOLECULAR WEIGHT: 164.16792
SMILES: CN1C=CN=C1CC2=NNN=N2
Structure:

CAS RN: 63925-50-8
CAS Name: 4-[2-[2-phenylethyl(propyl)amino]ethyl]benzene-1,2-diol hydrochloride
OPENEYE Name: 4-[2-[2-phenylethyl(propyl)amino]ethyl]benzene-1,2-diol hydrochloride
IUPAC Name: 4-[2-[2-phenylethyl(propyl)amino]ethyl]benzene-1,2-diol hydrochloride
SYSTEMATIC NAME: 4-[2-[2-phenylethyl(propyl)amino]ethyl]benzene-1,2-diol hydrochloride
MOLECULAR FORMULA: C19H26ClNO2
MOLECULAR WEIGHT: 335.86824
SMILES: CCCN(CCC1=CC=CC=C1)CCC2=CC(=C(C=C2)O)O.Cl
Structure:

CAS RN: 63925-46-2
CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylethanamine hydrobromide
OPENEYE Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenyl-ethanamine hydrobromide
IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylethanamine hydrobromide
SYSTEMATIC NAME: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenyl-ethanamine hydrobromide
MOLECULAR FORMULA: C18H24BrNO2
MOLECULAR WEIGHT: 366.29266
SMILES: COC1=C(C=C(C=C1)CCNCCC2=CC=CC=C2)OC.Br
Structure:

CAS RN: 63919-26-6
CAS Name: carbonic acid (2,6-dinitro-4-octan-3-ylphenyl) methyl ester; carbonic acid (2,6-dinitro-4-octan-4-ylphenyl) methyl ester
OPENEYE Name: [2,6-dinitro-4-(1-propylpentyl)phenyl] methyl carbonate; [4-(1-ethylhexyl)-2,6-dinitro-phenyl] methyl carbonate
IUPAC Name: (2,6-dinitro-4-octan-3-ylphenyl) methyl carbonate; (2,6-dinitro-4-octan-4-ylphenyl) methyl carbonate
SYSTEMATIC NAME: (2,6-dinitro-4-octan-3-yl-phenyl) methyl carbonate; (2,6-dinitro-4-octan-4-yl-phenyl) methyl carbonate
MOLECULAR FORMULA: C32H44N4O14
MOLECULAR WEIGHT: 708.71016
SMILES: CCCCCC(CC)C1=CC(=C(C(=C1)[N+](=O)[O-])OC(=O)OC)[N+](=O)[O-].CCCCC(CCC)C1=CC(=C(C(=C1)[N+](=O)[O-])OC(=O)OC)[N+](=O)[O-]
Structure:

CAS RN: 63919-21-1
CAS Name: cobalt(3+); iron; nitrilooxonium; pentacyanide
OPENEYE Name: cobaltic; iron; nitridooxonium; pentacyanide
IUPAC Name: azanylidyneoxidanium; cobalt(3+); iron; pentacyanide
SYSTEMATIC NAME: azanylidyneoxidanium; cobalt(3+); iron; pentacyanide
MOLECULAR FORMULA: C5CoFeN6O-
MOLECULAR WEIGHT: 274.8713
SMILES: [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.N#[O+].[Fe].[Co+3]
Structure:

CAS RN: 63919-17-5
CAS Name: ammonia; 2-(phenylmethyl)propanedioate; platinum(2+)
OPENEYE Name: ammonia; 2-benzylpropanedioate; platinum(2+)
IUPAC Name: azane; 2-benzylpropanedioate; platinum(2+)
SYSTEMATIC NAME: azane; 2-(phenylmethyl)propanedioate; platinum(2+)
MOLECULAR FORMULA: C10H14N2O4Pt
MOLECULAR WEIGHT: 421.30716
SMILES: C1=CC=C(C=C1)CC(C(=O)[O-])C(=O)[O-].N.N.[Pt+2]
Structure:

CAS RN: 63919-14-2
CAS Name: 2-hydroxypropanoate; zirconium(3+)
OPENEYE Name: 2-hydroxypropanoate; zirconium(3+)
IUPAC Name: 2-hydroxypropanoate; zirconium(3+)
SYSTEMATIC NAME: 2-oxidanylpropanoate; zirconium(3+)
MOLECULAR FORMULA: C9H15O9Zr
MOLECULAR WEIGHT: 358.434
SMILES: CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Zr+3]
Structure:

CAS RN: 63918-83-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H17NO4S
MOLECULAR WEIGHT: 391.43968
SMILES: COS(=O)(=O)O.C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5=CC=CC=C5C=C4
Structure:

CAS RN: 63918-80-9
CAS Name: 7-(2-chloroethyl)-N,N-dimethyl-7H-phenothiazin-1-amine
OPENEYE Name: 7-(2-chloroethyl)-N,N-dimethyl-7H-phenothiazin-1-amine
IUPAC Name: 7-(2-chloroethyl)-N,N-dimethyl-7H-phenothiazin-1-amine
SYSTEMATIC NAME: 7-(2-chloroethyl)-N,N-dimethyl-7H-phenothiazin-1-amine
MOLECULAR FORMULA: C16H17ClN2S
MOLECULAR WEIGHT: 304.83758
SMILES: CN(C)C1=C2C(=CC=C1)SC3=CC(C=CC3=N2)CCCl
Structure:

CAS RN: 63918-39-8
CAS Name: 2-(1-methyl-1-aziridin-1-iumyl)ethanol; 2,4,6-trinitrobenzenesulfonate
OPENEYE Name: 2-(1-methylaziridin-1-ium-1-yl)ethanol; 2,4,6-trinitrobenzenesulfonate
IUPAC Name: 2-(1-methylaziridin-1-ium-1-yl)ethanol; 2,4,6-trinitrobenzenesulfonate
SYSTEMATIC NAME: 2-(1-methylaziridin-1-ium-1-yl)ethanol; 2,4,6-trinitrobenzenesulfonate
MOLECULAR FORMULA: C11H14N4O10S
MOLECULAR WEIGHT: 394.31466
SMILES: C[N+]1(CC1)CCO.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 63918-32-1
CAS Name: 4-chloro-N-ethyl-2-[2-(phenylmethyl)phenoxy]-1-butanamine hydrochloride
OPENEYE Name: 2-(2-benzylphenoxy)-4-chloro-N-ethyl-butan-1-amine hydrochloride
IUPAC Name: 2-(2-benzylphenoxy)-4-chloro-N-ethylbutan-1-amine hydrochloride
SYSTEMATIC NAME: 4-chloranyl-N-ethyl-2-[2-(phenylmethyl)phenoxy]butan-1-amine hydrochloride
MOLECULAR FORMULA: C19H25Cl2NO
MOLECULAR WEIGHT: 354.3139
SMILES: CCNCC(CCCl)OC1=CC=CC=C1CC2=CC=CC=C2.Cl
Structure:

CAS RN: 63918-26-3
CAS Name: 2-(4-phenyldiazenylphenoxy)-N,N-bis[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
OPENEYE Name: 2-(4-phenylazophenoxy)-N,N-bis[2-(4-phenylazophenoxy)ethyl]ethanamine
IUPAC Name: 2-(4-phenyldiazenylphenoxy)-N,N-bis[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
SYSTEMATIC NAME: 2-(4-phenyldiazenylphenoxy)-N,N-bis[2-(4-phenyldiazenylphenoxy)ethyl]ethanamine
MOLECULAR FORMULA: C42H39N7O3
MOLECULAR WEIGHT: 689.80416
SMILES: C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCN(CCOC3=CC=C(C=C3)N=NC4=CC=CC=C4)CCOC5=CC=C(C=C5)N=NC6=CC=CC=C6
Structure:

CAS RN: 63918-21-8
CAS Name: 4-[2-(methylamino)ethyl]-1-cyclohexanol
OPENEYE Name: 4-[2-(methylamino)ethyl]cyclohexanol
IUPAC Name: 4-[2-(methylamino)ethyl]cyclohexan-1-ol
SYSTEMATIC NAME: 4-[2-(methylamino)ethyl]cyclohexan-1-ol
MOLECULAR FORMULA: C9H19NO
MOLECULAR WEIGHT: 157.25326
SMILES: CNCCC1CCC(CC1)O
Structure:

CAS RN: 63918-02-5
CAS Name: N-(2-chloroethyl)-N-[2-(2-methoxyphenoxy)ethyl]-2-(2-methylphenoxy)ethanamine hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-[2-(2-methoxyphenoxy)ethyl]-2-(2-methylphenoxy)ethanamine hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-[2-(2-methoxyphenoxy)ethyl]-2-(2-methylphenoxy)ethanamine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-[2-(2-methoxyphenoxy)ethyl]-2-(2-methylphenoxy)ethanamine hydrochloride
MOLECULAR FORMULA: C20H27Cl2NO3
MOLECULAR WEIGHT: 400.33928
SMILES: CC1=CC=CC=C1OCCN(CCOC2=CC=CC=C2OC)CCCl.Cl
Structure:

CAS RN: 63918-00-3
CAS Name: N-(2-chloroethyl)-N-ethyl-2-phenoxyethanamine hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-ethyl-2-phenoxy-ethanamine hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-ethyl-2-phenoxyethanamine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-ethyl-2-phenoxy-ethanamine hydrochloride
MOLECULAR FORMULA: C12H19Cl2NO
MOLECULAR WEIGHT: 264.19136
SMILES: CCN(CCOC1=CC=CC=C1)CCCl.Cl
Structure:

CAS RN: 63917-96-4
CAS Name: N-(2-chloroethyl)-N-ethyl-2-[(2-methylphenyl)thio]ethanamine hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-ethyl-2-(o-tolylsulfanyl)ethanamine hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenyl)sulfanylethanamine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenyl)sulfanyl-ethanamine hydrochloride
MOLECULAR FORMULA: C13H21Cl2NS
MOLECULAR WEIGHT: 294.28354
SMILES: CCN(CCSC1=CC=CC=C1C)CCCl.Cl
Structure:

CAS RN: 63917-94-2
CAS Name: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenoxy)ethanamine hydrochloride
OPENEYE Name: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenoxy)ethanamine hydrochloride
IUPAC Name: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenoxy)ethanamine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-N-ethyl-2-(2-methylphenoxy)ethanamine hydrochloride
MOLECULAR FORMULA: C13H21Cl2NO
MOLECULAR WEIGHT: 278.21794
SMILES: CCN(CCOC1=CC=CC=C1C)CCCl.Cl
Structure:

CAS RN: 63917-87-3
CAS Name: N-(2-chloroethyl)-2-phenoxy-N-(2-phenoxyethyl)ethanamine hydrochloride
OPENEYE Name: N-(2-chloroethyl)-2-phenoxy-N-(2-phenoxyethyl)ethanamine hydrochloride
IUPAC Name: N-(2-chloroethyl)-2-phenoxy-N-(2-phenoxyethyl)ethanamine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-2-phenoxy-N-(2-phenoxyethyl)ethanamine hydrochloride
MOLECULAR FORMULA: C18H23Cl2NO2
MOLECULAR WEIGHT: 356.28672
SMILES: C1=CC=C(C=C1)OCCN(CCOC2=CC=CC=C2)CCCl.Cl
Structure:

CAS RN: 63917-55-5
CAS Name: N,N-dimethyl-3-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]-1-propanamine dihydrate hydrochloride
OPENEYE Name: N,N-dimethyl-3-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]propan-1-amine dihydrate hydrochloride
IUPAC Name: N,N-dimethyl-3-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]propan-1-amine dihydrate hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-3-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]propan-1-amine dihydrate hydrochloride
MOLECULAR FORMULA: C19H32ClF3N2O2S
MOLECULAR WEIGHT: 444.98279
SMILES: CN(C)CCCN1C2CCCCCC2SC3=C1C=C(C=C3)C(F)(F)F.O.O.Cl
Structure:

http://ChemLookup.com Compounds

2012-02-27T19:36:00.001-08:00

CAS RN: 63957-39-1
CAS Name: 4-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
OPENEYE Name: 4-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
IUPAC Name: 4-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
SYSTEMATIC NAME: antimony(3+); 4-azanylphenol; 2,3-bis(oxidanidyl)butanedioate; hydron
MOLECULAR FORMULA: C20H20N2O14Sb2
MOLECULAR WEIGHT: 755.8978
SMILES: [H+].[H+].C1=CC(=CC=C1N)O.C1=CC(=CC=C1N)O.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 63957-38-0
CAS Name: 2-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
OPENEYE Name: 2-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
IUPAC Name: 2-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
SYSTEMATIC NAME: antimony(3+); 2-azanylphenol; 2,3-bis(oxidanidyl)butanedioate; hydron
MOLECULAR FORMULA: C20H20N2O14Sb2
MOLECULAR WEIGHT: 755.8978
SMILES: [H+].[H+].C1=CC=C(C(=C1)N)O.C1=CC=C(C(=C1)N)O.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 63957-37-9
CAS Name: 3-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
OPENEYE Name: 3-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
IUPAC Name: 3-aminophenol; antimony(3+); 2,3-dioxidobutanedioate; hydron
SYSTEMATIC NAME: antimony(3+); 3-azanylphenol; 2,3-bis(oxidanidyl)butanedioate; hydron
MOLECULAR FORMULA: C20H20N2O14Sb2
MOLECULAR WEIGHT: 755.8978
SMILES: [H+].[H+].C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 63957-36-8
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; 3-ethoxyaniline; hydron
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; 3-ethoxyaniline; hydron
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; 3-ethoxyaniline; hydron
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; 3-ethoxyaniline; hydron
MOLECULAR FORMULA: C24H28N2O14Sb2
MOLECULAR WEIGHT: 812.00412
SMILES: [H+].[H+].CCOC1=CC=CC(=C1)N.CCOC1=CC=CC(=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 63957-26-6
CAS Name: 1-[4-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]phenyl]-3-phenyl-1-propanone
OPENEYE Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-3-phenyl-propan-1-one
IUPAC Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-3-phenylpropan-1-one
SYSTEMATIC NAME: 1-[4-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-3-phenyl-propan-1-one
MOLECULAR FORMULA: C28H32N2O3
MOLECULAR WEIGHT: 444.56528
SMILES: C1CN(CCN1CC(COC2=CC=C(C=C2)C(=O)CCC3=CC=CC=C3)O)C4=CC=CC=C4
Structure:

CAS RN: 63954-69-8
CAS Name: 4-methyl-3-[(4-methyl-1-piperazinyl)-oxomethyl]-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 4-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 4-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 4-methyl-3-(4-methylpiperazin-1-yl)carbonyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C15H19N5O2
MOLECULAR WEIGHT: 301.34366
SMILES: CN1CCN(CC1)C(=O)C2=NNC3=CC=CC=C3C(=O)N2C
Structure:

CAS RN: 63950-91-4
CAS Name: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[[(2R,4S,5R,6R)-4-methoxy-6-methyl-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-
OPENEYE Name: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,4S,5R,6R)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopent
IUPAC Name: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,4S,5R,6R)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-
SYSTEMATIC NAME: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5R,6R)-5-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-methoxy-6-methyl-oxan-2-yl]oxy-10,13-dimethyl-14-oxidanyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-1
MOLECULAR FORMULA: C36H56O12
MOLECULAR WEIGHT: 680.82264
SMILES: C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O
Structure:

CAS RN: 63942-70-1
CAS Name: 1-(dimethylamino)-2-methyl-3-pentanone hydrochloride
OPENEYE Name: 1-(dimethylamino)-2-methyl-pentan-3-one hydrochloride
IUPAC Name: 1-(dimethylamino)-2-methylpentan-3-one hydrochloride
SYSTEMATIC NAME: 1-(dimethylamino)-2-methyl-pentan-3-one hydrochloride
MOLECULAR FORMULA: C8H18ClNO
MOLECULAR WEIGHT: 179.68762
SMILES: CCC(=O)C(C)CN(C)C.Cl
Structure:

CAS RN: 63938-49-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H68N2O8
MOLECULAR WEIGHT: 777.04072
SMILES: CC12CCCC3(C1CCC45C3CCC(C4)C(=C)C5O)C6N(C2)CCO6.CC12CCCC3(C1CCC45C3CCC(C4)C(=C)C5O)C6N(C2)CCO6.C(=O)(C(=O)O)O
Structure:

CAS RN: 63938-28-3
CAS Name: (2R)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline-11,12-diol hydrochloride
OPENEYE Name: (2R)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline-11,12-diol hydrochloride
IUPAC Name: (2R)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline-11,12-diol hydrochloride
SYSTEMATIC NAME: (2R)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline-11,12-diol hydrochloride
MOLECULAR FORMULA: C17H20ClNO3
MOLECULAR WEIGHT: 321.7986
SMILES: CO[C@@H]1CC23C(=CCN2CCC4=CC(=C(C=C34)O)O)C=C1.Cl
Structure:

CAS RN: 63938-27-2
CAS Name: (2R)-2,12-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-11-ol hydrochloride
OPENEYE Name: (2R)-2,12-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-11-ol hydrochloride
IUPAC Name: (2R)-2,12-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-11-ol hydrochloride
SYSTEMATIC NAME: (2R)-2,12-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-11-ol hydrochloride
MOLECULAR FORMULA: C18H22ClNO3
MOLECULAR WEIGHT: 335.82518
SMILES: CO[C@@H]1CC23C(=CCN2CCC4=CC(=C(C=C34)OC)O)C=C1.Cl
Structure:

CAS RN: 63938-26-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H29N3O8
MOLECULAR WEIGHT: 487.50236
SMILES: CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N5CCOCC5.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:

CAS RN: 63938-25-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H23N3O2
MOLECULAR WEIGHT: 373.44762
SMILES: CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)NOCC5=CC=CC=C5
Structure:

CAS RN: 63938-24-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H39N3O14
MOLECULAR WEIGHT: 665.64236
SMILES: CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C(=O)C)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:

CAS RN: 63931-97-5
CAS Name: 7-chloro-3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-phenyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 7-chloro-3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 7-chloro-3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 7-chloranyl-3-(4-methylpiperazin-1-yl)carbonyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C20H20ClN5O2
MOLECULAR WEIGHT: 397.8581
SMILES: CN1CCN(CC1)C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)N2C4=CC=CC=C4
Structure:

CAS RN: 63931-96-4
CAS Name: 7-chloro-N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: 7-chloro-N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: 7-chloro-N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: 7-chloranyl-N,N-diethyl-5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C19H19ClN4O2
MOLECULAR WEIGHT: 370.83276
SMILES: CCN(CC)C(=O)C1=NNC2=C(C=C(C=C2)Cl)C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-95-3
CAS Name: 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: 7-chloranyl-5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C15H11ClN4O2
MOLECULAR WEIGHT: 314.72644
SMILES: C1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)Cl)NN=C2C(=O)N
Structure:

CAS RN: 63931-94-2
CAS Name: 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(diethylamino)ethyl 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 7-chloranyl-5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C21H23ClN4O3
MOLECULAR WEIGHT: 414.88532
SMILES: CCN(CC)CCOC(=O)C1=NNC2=C(C=C(C=C2)Cl)C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-93-1
CAS Name: 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(dimethylamino)ethyl 7-chloro-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 7-chloranyl-5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C19H19ClN4O3
MOLECULAR WEIGHT: 386.83216
SMILES: CN(C)CCOC(=O)C1=NNC2=C(C=C(C=C2)Cl)C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-92-0
CAS Name: 3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-phenyl-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 3-(4-methylpiperazin-1-yl)carbonyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C20H21N5O2
MOLECULAR WEIGHT: 363.41304
SMILES: CN1CCN(CC1)C(=O)C2=NNC3=CC=CC=C3C(=O)N2C4=CC=CC=C4
Structure:

CAS RN: 63931-91-9
CAS Name: N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: N,N-diethyl-5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: N,N-diethyl-5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C19H20N4O2
MOLECULAR WEIGHT: 336.3877
SMILES: CCN(CC)C(=O)C1=NNC2=CC=CC=C2C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-89-5
CAS Name: 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(diethylamino)ethyl 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C21H24N4O3
MOLECULAR WEIGHT: 380.44026
SMILES: CCN(CC)CCOC(=O)C1=NNC2=CC=CC=C2C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-88-4
CAS Name: 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(dimethylamino)ethyl 5-oxo-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 5-oxidanylidene-4-phenyl-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C19H20N4O3
MOLECULAR WEIGHT: 352.3871
SMILES: CN(C)CCOC(=O)C1=NNC2=CC=CC=C2C(=O)N1C3=CC=CC=C3
Structure:

CAS RN: 63931-87-3
CAS Name: 7-chloro-4-methyl-3-[(4-methyl-1-piperazinyl)-oxomethyl]-1H-1,2,4-benzotriazepin-5-one
OPENEYE Name: 7-chloro-4-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-1,2,4-benzotriazepin-5-one
IUPAC Name: 7-chloro-4-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-1,2,4-benzotriazepin-5-one
SYSTEMATIC NAME: 7-chloranyl-4-methyl-3-(4-methylpiperazin-1-yl)carbonyl-1H-1,2,4-benzotriazepin-5-one
MOLECULAR FORMULA: C15H18ClN5O2
MOLECULAR WEIGHT: 335.78872
SMILES: CN1CCN(CC1)C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)N2C
Structure:

CAS RN: 63931-85-1
CAS Name: 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: 7-chloranyl-4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C10H9ClN4O2
MOLECULAR WEIGHT: 252.65706
SMILES: CN1C(=O)C2=C(C=CC(=C2)Cl)NN=C1C(=O)N
Structure:

CAS RN: 63931-84-0
CAS Name: 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(diethylamino)ethyl 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 7-chloranyl-4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C16H21ClN4O3
MOLECULAR WEIGHT: 352.81594
SMILES: CCN(CC)CCOC(=O)C1=NNC2=C(C=C(C=C2)Cl)C(=O)N1C
Structure:

CAS RN: 63931-83-9
CAS Name: 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(dimethylamino)ethyl 7-chloro-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 7-chloranyl-4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C14H17ClN4O3
MOLECULAR WEIGHT: 324.76278
SMILES: CN1C(=O)C2=C(C=CC(=C2)Cl)NN=C1C(=O)OCCN(C)C
Structure:

CAS RN: 63931-82-8
CAS Name: N,N-diethyl-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: N,N-diethyl-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: N,N-diethyl-4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: N,N-diethyl-4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C14H18N4O2
MOLECULAR WEIGHT: 274.31832
SMILES: CCN(CC)C(=O)C1=NNC2=CC=CC=C2C(=O)N1C
Structure:

CAS RN: 63931-81-7
CAS Name: 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
OPENEYE Name: 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
IUPAC Name: 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxamide
SYSTEMATIC NAME: 4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxamide
MOLECULAR FORMULA: C10H10N4O2
MOLECULAR WEIGHT: 218.212
SMILES: CN1C(=O)C2=CC=CC=C2NN=C1C(=O)N
Structure:

CAS RN: 63931-80-6
CAS Name: 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(diethylamino)ethyl 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C16H22N4O3
MOLECULAR WEIGHT: 318.37088
SMILES: CCN(CC)CCOC(=O)C1=NNC2=CC=CC=C2C(=O)N1C
Structure:

CAS RN: 63931-79-3
CAS Name: 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
IUPAC Name: 2-(dimethylamino)ethyl 4-methyl-5-oxo-1H-1,2,4-benzotriazepine-3-carboxylate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 4-methyl-5-oxidanylidene-1H-1,2,4-benzotriazepine-3-carboxylate
MOLECULAR FORMULA: C14H18N4O3
MOLECULAR WEIGHT: 290.31772
SMILES: CN1C(=O)C2=CC=CC=C2NN=C1C(=O)OCCN(C)C
Structure:

http://ChemLookup.com Compounds

2012-02-27T18:36:00.001-08:00

CAS RN: 63978-60-9
CAS Name: 8-[bis(2-hydroxyethyl)amino]-7-[3-[8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-2,6-dioxo-7-purinyl]propyl]-1,3-dimethylpurine-2,6-dione
OPENEYE Name: 8-[bis(2-hydroxyethyl)amino]-7-[3-[8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-2,6-dioxo-purin-7-yl]propyl]-1,3-dimethyl-purine-2,6-dione
IUPAC Name: 8-[bis(2-hydroxyethyl)amino]-7-[3-[8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-2,6-dioxopurin-7-yl]propyl]-1,3-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-[bis(2-hydroxyethyl)amino]-7-[3-[8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propyl]-1,3-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C25H38N10O8
MOLECULAR WEIGHT: 606.63142
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(CCO)CCO)CCCN3C4=C(N=C3N(CCO)CCO)N(C(=O)N(C4=O)C)C
Structure:

CAS RN: 63978-20-1
CAS Name: 2-hydroxy-2-phenylacetic acid [8-methyl-8-(1-naphthalenylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] ester chloride
OPENEYE Name: [8-methyl-8-(1-naphthylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenyl-acetate chloride
IUPAC Name: [8-methyl-8-(naphthalen-1-ylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate chloride
SYSTEMATIC NAME: [8-methyl-8-(naphthalen-1-ylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate chloride
MOLECULAR FORMULA: C27H30ClNO3
MOLECULAR WEIGHT: 451.985
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)CC4=CC=CC5=CC=CC=C54.[Cl-]
Structure:

CAS RN: 63978-19-8
CAS Name: 2-hydroxy-2-phenylacetic acid [8-methyl-8-[(4-methylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [8-methyl-8-(p-tolylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: [8-methyl-8-[(4-methylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-methyl-8-[(4-methylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C24H30BrNO3
MOLECULAR WEIGHT: 460.4039
SMILES: CC1=CC=C(C=C1)C[N+]2(C3CCC2CC(C3)OC(=O)C(C4=CC=CC=C4)O)C.[Br-]
Structure:

CAS RN: 63977-82-2
CAS Name: 2-hydroxy-2-phenylacetic acid [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C23H27BrClNO3
MOLECULAR WEIGHT: 480.82238
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)CC4=CC=C(C=C4)Cl.[Br-]
Structure:

CAS RN: 63977-81-1
CAS Name: 2-(4-aminophenyl)-2-hydroxy-2-phenylacetic acid [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-(4-aminophenyl)-2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-(4-aminophenyl)-2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-[(4-chlorophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-(4-aminophenyl)-2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C29H32BrClN2O3
MOLECULAR WEIGHT: 571.93298
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=C(C=C4)N)O)CC5=CC=C(C=C5)Cl.[Br-]
Structure:

CAS RN: 63977-80-0
CAS Name: 2-hydroxy-2-phenylacetic acid [8-[(4-bromophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [8-[(4-bromophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: [8-[(4-bromophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-[(4-bromophenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C23H27Br2NO3
MOLECULAR WEIGHT: 525.27338
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)CC4=CC=C(C=C4)Br.[Br-]
Structure:

CAS RN: 63977-79-7
CAS Name: 2-hydroxy-2-phenylacetic acid [8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: [8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C29H32BrNO3
MOLECULAR WEIGHT: 522.47328
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)CC4=CC=C(C=C4)C5=CC=CC=C5.[Br-]
Structure:

CAS RN: 63977-78-6
CAS Name: 2-hydroxy-2-phenylacetic acid [8-methyl-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: (8-benzyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: (8-benzyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-methyl-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C23H28BrNO3
MOLECULAR WEIGHT: 446.37732
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)CC4=CC=CC=C4.[Br-]
Structure:

CAS RN: 63977-75-3
CAS Name: 2-(4-aminophenyl)-2-hydroxy-2-phenylacetic acid [8-methyl-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: (8-benzyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(4-aminophenyl)-2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: (8-benzyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(4-aminophenyl)-2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: [8-methyl-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octan-3-yl] 2-(4-aminophenyl)-2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C29H33BrN2O3
MOLECULAR WEIGHT: 537.48792
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=C(C=C4)N)O)CC5=CC=CC=C5.[Br-]
Structure:

CAS RN: 63972-31-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H24O10
MOLECULAR WEIGHT: 460.43066
SMILES: CC1C2=C(C3=C(C(=C2CC(O1)CC(=O)OC)O)C(=O)C4=C(C3=O)C5(C(OC4CC5O)C)O)O
Structure:

CAS RN: 63967-13-5
CAS Name: N-phenylcarbamic acid [1-chloro-3-(3-chlorophenoxy)propan-2-yl] ester
OPENEYE Name: [1-(chloromethyl)-2-(3-chlorophenoxy)ethyl] N-phenylcarbamate
IUPAC Name: [1-chloro-3-(3-chlorophenoxy)propan-2-yl] N-phenylcarbamate
SYSTEMATIC NAME: [1-chloranyl-3-(3-chloranylphenoxy)propan-2-yl] N-phenylcarbamate
MOLECULAR FORMULA: C16H15Cl2NO3
MOLECULAR WEIGHT: 340.2012
SMILES: C1=CC=C(C=C1)NC(=O)OC(COC2=CC(=CC=C2)Cl)CCl
Structure:

CAS RN: 63967-11-3
CAS Name: N-ethylcarbamic acid (1-chloro-3-phenoxypropan-2-yl) ester
OPENEYE Name: [1-(chloromethyl)-2-phenoxy-ethyl] N-ethylcarbamate
IUPAC Name: (1-chloro-3-phenoxypropan-2-yl) N-ethylcarbamate
SYSTEMATIC NAME: (1-chloranyl-3-phenoxy-propan-2-yl) N-ethylcarbamate
MOLECULAR FORMULA: C12H16ClNO3
MOLECULAR WEIGHT: 257.71334
SMILES: CCNC(=O)OC(COC1=CC=CC=C1)CCl
Structure:

http://ChemLookup.com Compounds

2012-02-27T17:35:00.001-08:00

CAS RN: 63998-37-8
CAS Name: 2-[3-(butylthio)propylamino]-1-(2,3-dihydro-1H-inden-5-yl)-1-propanol hydrochloride
OPENEYE Name: 2-(3-butylsulfanylpropylamino)-1-indan-5-yl-propan-1-ol hydrochloride
IUPAC Name: 2-(3-butylsulfanylpropylamino)-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol hydrochloride
SYSTEMATIC NAME: 2-(3-butylsulfanylpropylamino)-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol hydrochloride
MOLECULAR FORMULA: C19H32ClNOS
MOLECULAR WEIGHT: 357.98148
SMILES: CCCCSCCCNC(C)C(C1=CC2=C(CCC2)C=C1)O.Cl
Structure:

CAS RN: 63998-35-6
CAS Name: 2-[2-(4-tert-butylphenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)-1-propanol
OPENEYE Name: 2-[2-(4-tert-butylphenoxy)ethylamino]-1-indan-5-yl-propan-1-ol
IUPAC Name: 2-[2-(4-tert-butylphenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
SYSTEMATIC NAME: 2-[2-(4-tert-butylphenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
MOLECULAR FORMULA: C24H33NO2
MOLECULAR WEIGHT: 367.52432
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCOC3=CC=C(C=C3)C(C)(C)C
Structure:

CAS RN: 63998-33-4
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenyl-1-piperidinyl)-1-propanol hydrochloride
OPENEYE Name: 1-indan-5-yl-2-(4-phenyl-1-piperidyl)propan-1-ol hydrochloride
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylpiperidin-1-yl)propan-1-ol hydrochloride
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylpiperidin-1-yl)propan-1-ol hydrochloride
MOLECULAR FORMULA: C23H30ClNO
MOLECULAR WEIGHT: 371.9434
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)N3CCC(CC3)C4=CC=CC=C4.Cl
Structure:

CAS RN: 63998-32-3
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-phenylpentan-2-ylamino)-1-propanol hydrochloride
OPENEYE Name: 1-indan-5-yl-2-[(1-methyl-4-phenyl-butyl)amino]propan-1-ol hydrochloride
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-phenylpentan-2-ylamino)propan-1-ol hydrochloride
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-phenylpentan-2-ylamino)propan-1-ol hydrochloride
MOLECULAR FORMULA: C23H32ClNO
MOLECULAR WEIGHT: 373.95928
SMILES: CC(CCCC1=CC=CC=C1)NC(C)C(C2=CC3=C(CCC3)C=C2)O.Cl
Structure:

CAS RN: 63998-31-2
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(phenylmethyl)-1-piperidinyl]-1-propanol
OPENEYE Name: 2-(4-benzyl-1-piperidyl)-1-indan-5-yl-propan-1-ol
IUPAC Name: 2-(4-benzylpiperidin-1-yl)-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(phenylmethyl)piperidin-1-yl]propan-1-ol
MOLECULAR FORMULA: C24H31NO
MOLECULAR WEIGHT: 349.50904
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)N3CCC(CC3)CC4=CC=CC=C4
Structure:

CAS RN: 63998-29-8
CAS Name: 2-(octylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)-1-propanol
OPENEYE Name: 2-(octylamino)-1-tetralin-6-yl-propan-1-ol
IUPAC Name: 2-(octylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
SYSTEMATIC NAME: 2-(octylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
MOLECULAR FORMULA: C21H35NO
MOLECULAR WEIGHT: 317.5087
SMILES: CCCCCCCCNC(C)C(C1=CC2=C(CCCC2)C=C1)O
Structure:

CAS RN: 63998-28-7
CAS Name: 2-[2-(4-chlorophenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)-1-propanol
OPENEYE Name: 2-[2-(4-chlorophenoxy)ethylamino]-1-indan-5-yl-propan-1-ol
IUPAC Name: 2-[2-(4-chlorophenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
SYSTEMATIC NAME: 2-[2-(4-chloranylphenoxy)ethylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
MOLECULAR FORMULA: C20H24ClNO2
MOLECULAR WEIGHT: 345.86306
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCOC3=CC=C(C=C3)Cl
Structure:

CAS RN: 63998-27-6
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-phenoxyethylamino)-1-propanol
OPENEYE Name: 1-indan-5-yl-2-(2-phenoxyethylamino)propan-1-ol
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-phenoxyethylamino)propan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-phenoxyethylamino)propan-1-ol
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCOC3=CC=CC=C3
Structure:

CAS RN: 63998-26-5
CAS Name: 2-[4-(4-chlorophenyl)butylamino]-1-(2,3-dihydro-1H-inden-5-yl)-1-propanol
OPENEYE Name: 2-[4-(4-chlorophenyl)butylamino]-1-indan-5-yl-propan-1-ol
IUPAC Name: 2-[4-(4-chlorophenyl)butylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)butylamino]-1-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
MOLECULAR FORMULA: C22H28ClNO
MOLECULAR WEIGHT: 357.91682
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCCCC3=CC=C(C=C3)Cl
Structure:

CAS RN: 63998-24-3
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-phenylpropylamino)-1-propanol
OPENEYE Name: 1-indan-5-yl-2-(3-phenylpropylamino)propan-1-ol
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-phenylpropylamino)propan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-phenylpropylamino)propan-1-ol
MOLECULAR FORMULA: C21H27NO
MOLECULAR WEIGHT: 309.44518
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCCC3=CC=CC=C3
Structure:

CAS RN: 63998-23-2
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(octylamino)-1-propanol
OPENEYE Name: 1-indan-5-yl-2-(octylamino)propan-1-ol
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(octylamino)propan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(octylamino)propan-1-ol
MOLECULAR FORMULA: C20H33NO
MOLECULAR WEIGHT: 303.48212
SMILES: CCCCCCCCNC(C)C(C1=CC2=C(CCC2)C=C1)O
Structure:

CAS RN: 63998-22-1
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylbutylamino)-1-propanol
OPENEYE Name: 1-indan-5-yl-2-(4-phenylbutylamino)propan-1-ol
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylbutylamino)propan-1-ol
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylbutylamino)propan-1-ol
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCCCC3=CC=CC=C3
Structure:

CAS RN: 63991-56-0
CAS Name: trimethyl-[3-(2-methyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]ammonium dibromide
OPENEYE Name: trimethyl-[3-(2-methyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]ammonium dibromide
IUPAC Name: trimethyl-[3-(2-methyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]azanium dibromide
SYSTEMATIC NAME: trimethyl-[3-(2-methyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]azanium dibromide
MOLECULAR FORMULA: C19H28Br2N2
MOLECULAR WEIGHT: 444.24702
SMILES: C[N+]1(CC2=CC=CC3=C2C(=CC=C3)C1)CCC[N+](C)(C)C.[Br-].[Br-]
Structure:

CAS RN: 63991-55-9
CAS Name: 2-methyl-2-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide
OPENEYE Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide
IUPAC Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide
SYSTEMATIC NAME: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide
MOLECULAR FORMULA: C21H30Br2N2
MOLECULAR WEIGHT: 470.2843
SMILES: C[N+]1(CCCC1)CCC[N+]2(CC3=CC=CC4=C3C(=CC=C4)C2)C.[Br-].[Br-]
Structure:

CAS RN: 63991-54-8
CAS Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethylammonium dibromide
OPENEYE Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-ammonium dibromide
IUPAC Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethylazanium dibromide
SYSTEMATIC NAME: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-azanium dibromide
MOLECULAR FORMULA: C21H32Br2N2
MOLECULAR WEIGHT: 472.30018
SMILES: CC[N+]1(CC2=CC=CC3=C2C(=CC=C3)C1)CCC[N+](C)(C)CC.[Br-].[Br-]
Structure:

CAS RN: 63991-12-8
CAS Name: N-(2-chloroethyl)-1-(2-methylphenoxy)-N-(phenylmethyl)-2-propanamine hydrochloride
OPENEYE Name: N-benzyl-N-(2-chloroethyl)-1-(2-methylphenoxy)propan-2-amine hydrochloride
IUPAC Name: N-benzyl-N-(2-chloroethyl)-1-(2-methylphenoxy)propan-2-amine hydrochloride
SYSTEMATIC NAME: N-(2-chloroethyl)-1-(2-methylphenoxy)-N-(phenylmethyl)propan-2-amine hydrochloride
MOLECULAR FORMULA: C19H25Cl2NO
MOLECULAR WEIGHT: 354.3139
SMILES: CC1=CC=CC=C1OCC(C)N(CCCl)CC2=CC=CC=C2.Cl
Structure:

CAS RN: 63990-95-4
CAS Name: 2,3,4,5-tetrabromo-6-(2-hydroxyphenyl)phenol
OPENEYE Name: 2,3,4,5-tetrabromo-6-(2-hydroxyphenyl)phenol
IUPAC Name: 2,3,4,5-tetrabromo-6-(2-hydroxyphenyl)phenol
SYSTEMATIC NAME: 2,3,4,5-tetrakis(bromanyl)-6-(2-hydroxyphenyl)phenol
MOLECULAR FORMULA: C12H6Br4O2
MOLECULAR WEIGHT: 501.79084
SMILES: C1=CC=C(C(=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)O)O
Structure:

CAS RN: 63990-93-2
CAS Name: 2,3,5-tribromo-4-(4-hydroxy-3-methylphenyl)-6-methylphenol
OPENEYE Name: 2,3,5-tribromo-4-(4-hydroxy-3-methyl-phenyl)-6-methyl-phenol
IUPAC Name: 2,3,5-tribromo-4-(4-hydroxy-3-methylphenyl)-6-methylphenol
SYSTEMATIC NAME: 2,3,5-tris(bromanyl)-6-methyl-4-(3-methyl-4-oxidanyl-phenyl)phenol
MOLECULAR FORMULA: C14H11Br3O2
MOLECULAR WEIGHT: 450.94794
SMILES: CC1=C(C=CC(=C1)C2=C(C(=C(C(=C2Br)Br)O)C)Br)O
Structure:

CAS RN: 63990-90-9
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-decylbenzenesulfonic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-decylbenzenesulfonic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-decylbenzenesulfonic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-decylbenzenesulfonic acid
MOLECULAR FORMULA: C22H41NO6S
MOLECULAR WEIGHT: 447.62904
SMILES: CCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CO)N(CCO)CCO
Structure:

CAS RN: 63990-89-6
CAS Name: dipotassium [2-hydroxy-3-(2-methylphenoxy)propyl] phosphate
OPENEYE Name: dipotassium [2-hydroxy-3-(2-methylphenoxy)propyl] phosphate
IUPAC Name: dipotassium [2-hydroxy-3-(2-methylphenoxy)propyl] phosphate
SYSTEMATIC NAME: dipotassium [3-(2-methylphenoxy)-2-oxidanyl-propyl] phosphate
MOLECULAR FORMULA: C10H13K2O6P
MOLECULAR WEIGHT: 338.376981
SMILES: CC1=CC=CC=C1OCC(COP(=O)([O-])[O-])O.[K+].[K+]
Structure:

CAS RN: 63989-76-4
CAS Name: (E)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxy-2-propenoic acid methyl ester; (2R,3R)-2,3-dihydroxybutanedioic acid
OPENEYE Name: (2R,3R)-2,3-dihydroxybutanedioic acid; methyl (E)-2-[(2S,3R,12bS)-3-vinyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxy-prop-2-enoate
IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid; methyl (E)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
SYSTEMATIC NAME: (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; methyl (E)-2-[(2S,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxy-prop-2-enoate
MOLECULAR FORMULA: C26H32N2O9
MOLECULAR WEIGHT: 516.54028
SMILES: CO/C=C(\[C@H]1C[C@H]2C3=C(CCN2C[C@@H]1C=C)C4=CC=CC=C4N3)/C(=O)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:

CAS RN: 63986-52-7
CAS Name: N-(4-butoxy-2-methylphenyl)carbamic acid 2-(4-morpholinyl)ethyl ester
OPENEYE Name: 2-morpholinoethyl N-(4-butoxy-2-methyl-phenyl)carbamate
IUPAC Name: 2-morpholin-4-ylethyl N-(4-butoxy-2-methylphenyl)carbamate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl N-(4-butoxy-2-methyl-phenyl)carbamate
MOLECULAR FORMULA: C18H28N2O4
MOLECULAR WEIGHT: 336.42592
SMILES: CCCCOC1=CC(=C(C=C1)NC(=O)OCCN2CCOCC2)C
Structure:

CAS RN: 63986-50-5
CAS Name: N-(2-methyl-4-pentoxyphenyl)carbamic acid 2-(dibutylamino)ethyl ester
OPENEYE Name: 2-(dibutylamino)ethyl N-(2-methyl-4-pentoxy-phenyl)carbamate
IUPAC Name: 2-(dibutylamino)ethyl N-(2-methyl-4-pentoxyphenyl)carbamate
SYSTEMATIC NAME: 2-(dibutylamino)ethyl N-(2-methyl-4-pentoxy-phenyl)carbamate
MOLECULAR FORMULA: C23H40N2O3
MOLECULAR WEIGHT: 392.5753
SMILES: CCCCCOC1=CC(=C(C=C1)NC(=O)OCCN(CCCC)CCCC)C
Structure:

CAS RN: 63986-49-2
CAS Name: N-(4-butoxy-2-methylphenyl)carbamic acid 2-(dibutylamino)ethyl ester
OPENEYE Name: 2-(dibutylamino)ethyl N-(4-butoxy-2-methyl-phenyl)carbamate
IUPAC Name: 2-(dibutylamino)ethyl N-(4-butoxy-2-methylphenyl)carbamate
SYSTEMATIC NAME: 2-(dibutylamino)ethyl N-(4-butoxy-2-methyl-phenyl)carbamate
MOLECULAR FORMULA: C22H38N2O3
MOLECULAR WEIGHT: 378.54872
SMILES: CCCCN(CCCC)CCOC(=O)NC1=C(C=C(C=C1)OCCCC)C
Structure:

CAS RN: 63985-67-1
CAS Name: 3-phenoxypropyl(triphenyl)phosphonium bromide
OPENEYE Name: 3-phenoxypropyl(triphenyl)phosphonium bromide
IUPAC Name: 3-phenoxypropyl(triphenyl)phosphanium bromide
SYSTEMATIC NAME: 3-phenoxypropyl(triphenyl)phosphanium bromide
MOLECULAR FORMULA: C27H26BrOP
MOLECULAR WEIGHT: 477.372501
SMILES: C1=CC=C(C=C1)OCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Structure:

CAS RN: 63983-43-7
CAS Name: (2S)-2-[[(2S)-2-amino-3-(3,4-diacetyloxyphenyl)-1-oxopropyl]amino]-3-(3,4-diacetyloxyphenyl)propanoic acid (phenylmethyl) ester hydrochloride
OPENEYE Name: benzyl (2S)-2-[[(2S)-2-amino-3-(3,4-diacetoxyphenyl)propanoyl]amino]-3-(3,4-diacetoxyphenyl)propanoate hydrochloride
IUPAC Name: benzyl (2S)-2-[[(2S)-2-amino-3-(3,4-diacetyloxyphenyl)propanoyl]amino]-3-(3,4-diacetyloxyphenyl)propanoate hydrochloride
SYSTEMATIC NAME: (phenylmethyl) (2S)-2-[[(2S)-2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]-3-(3,4-diacetyloxyphenyl)propanoate hydrochloride
MOLECULAR FORMULA: C33H35ClN2O11
MOLECULAR WEIGHT: 671.0908
SMILES: CC(=O)OC1=C(C=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CC(=C(C=C2)OC(=O)C)OC(=O)C)C(=O)OCC3=CC=CC=C3)N)OC(=O)C.Cl
Structure:

CAS RN: 63982-55-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H51NO10
MOLECULAR WEIGHT: 633.76944
SMILES: C[C@H]1CC[C@H]2[C@@](C3([C@@H](CN2C1)C4(CC56[C@H](C4CC3O)CCC7[C@@]5(CCC(C7(O6)O)(/C(=C(\C)/C(=O)O)/C)OC(=O)C)C)O)O)(C)O
Structure:

CAS RN: 63981-28-2
CAS Name: 1,1,1,2-tetrachloroundecane
OPENEYE Name: 1,1,1,2-tetrachloroundecane
IUPAC Name: 1,1,1,2-tetrachloroundecane
SYSTEMATIC NAME: 1,1,1,2-tetrakis(chloranyl)undecane
MOLECULAR FORMULA: C11H20Cl4
MOLECULAR WEIGHT: 294.0885
SMILES: CCCCCCCCCC(C(Cl)(Cl)Cl)Cl
Structure:

CAS RN: 63981-14-6
CAS Name: 2-(2,3,3-trichloro-1-oxoprop-2-enoxy)benzoic acid
OPENEYE Name: 2-(2,3,3-trichloroprop-2-enoyloxy)benzoic acid
IUPAC Name: 2-(2,3,3-trichloroprop-2-enoyloxy)benzoic acid
SYSTEMATIC NAME: 2-[2,3,3-tris(chloranyl)prop-2-enoyloxy]benzoic acid
MOLECULAR FORMULA: C10H5Cl3O4
MOLECULAR WEIGHT: 295.5033
SMILES: C1=CC=C(C(=C1)C(=O)O)OC(=O)C(=C(Cl)Cl)Cl
Structure:

CAS RN: 63980-96-1
CAS Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N-methylbenzenesulfonamide
OPENEYE Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N-methyl-benzenesulfonamide
IUPAC Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N-methylbenzenesulfonamide
SYSTEMATIC NAME: N-cyclohexylcyclohexanamine; 4-[methoxy(oxidanyl)phosphinothioyl]oxy-N-methyl-benzenesulfonamide
MOLECULAR FORMULA: C20H35N2O5PS2
MOLECULAR WEIGHT: 478.606061
SMILES: CNS(=O)(=O)C1=CC=C(C=C1)OP(=S)(O)OC.C1CCC(CC1)NC2CCCCC2
Structure:

CAS RN: 63980-95-0
CAS Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N,N-dimethylbenzenesulfonamide
OPENEYE Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N,N-dimethyl-benzenesulfonamide
IUPAC Name: N-cyclohexylcyclohexanamine; 4-[hydroxy(methoxy)phosphinothioyl]oxy-N,N-dimethylbenzenesulfonamide
SYSTEMATIC NAME: N-cyclohexylcyclohexanamine; 4-[methoxy(oxidanyl)phosphinothioyl]oxy-N,N-dimethyl-benzenesulfonamide
MOLECULAR FORMULA: C21H37N2O5PS2
MOLECULAR WEIGHT: 492.632641
SMILES: CN(C)S(=O)(=O)C1=CC=C(C=C1)OP(=S)(O)OC.C1CCC(CC1)NC2CCCCC2
Structure:

CAS RN: 63980-59-6
CAS Name: (2R,3R)-2,3-dihydroxybutanedioic acid; 2-(dimethylamino)ethanol
OPENEYE Name: (2R,3R)-2,3-dihydroxybutanedioic acid; 2-(dimethylamino)ethanol
IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid; 2-(dimethylamino)ethanol
SYSTEMATIC NAME: (2R,3R)-2,3-bis(oxidanyl)butanedioic acid; 2-(dimethylamino)ethanol
MOLECULAR FORMULA: C12H23NO13
MOLECULAR WEIGHT: 389.30992
SMILES: CN(C)CCO.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:

CAS RN: 63980-45-0
CAS Name: [4-methoxy-3,5-bis(phenylmethoxy)phenyl]-[4-[[4-methoxy-3,5-bis(phenylmethoxy)phenyl]-oxomethyl]-1-piperazinyl]methanone
OPENEYE Name: [4-(3,5-dibenzyloxy-4-methoxy-benzoyl)piperazin-1-yl]-(3,5-dibenzyloxy-4-methoxy-phenyl)methanone
IUPAC Name: [4-[4-methoxy-3,5-bis(phenylmethoxy)benzoyl]piperazin-1-yl]-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]methanone
SYSTEMATIC NAME: [4-methoxy-3,5-bis(phenylmethoxy)phenyl]-[4-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]carbonylpiperazin-1-yl]methanone
MOLECULAR FORMULA: C48H46N2O8
MOLECULAR WEIGHT: 778.88744
SMILES: COC1=C(C=C(C=C1OCC2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC(=C(C(=C4)OCC5=CC=CC=C5)OC)OCC6=CC=CC=C6)OCC7=CC=CC=C7
Structure:

CAS RN: 63980-39-2
CAS Name: acetic acid [(3S,5S,8R,9S,10S,11R,13R,17R)-10-formyl-5,11-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[[(2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-14-yl] ester
OPENEYE Name: [(3S,5S,8R,9S,10S,11R,13R,17R)-10-formyl-5,11-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-14-yl] acetate
IUPAC Name: [(3S,5S,8R,9S,10S,11R,13R,17R)-10-formyl-5,11-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-14-yl] acetate
SYSTEMATIC NAME: [(3S,5S,8R,9S,10S,11R,13R,17R)-10-methanoyl-13-methyl-3-[(2R,3R,4R,5S,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,11-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-14-yl] ethanoat
MOLECULAR FORMULA: C31H44O12
MOLECULAR WEIGHT: 608.67386
SMILES: C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)C5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)OC(=O)C)C=O)O)O)O
Structure:

CAS RN: 63980-24-5
CAS Name: 4-[(4-hydroxyphenyl)methyl]phenol; N,N,N',N'-tetramethyldecane-1,10-diamine; dihydrobromide
OPENEYE Name: 4-[(4-hydroxyphenyl)methyl]phenol; N,N,N',N'-tetramethyldecane-1,10-diamine; dihydrobromide
IUPAC Name: 4-[(4-hydroxyphenyl)methyl]phenol; N,N,N',N'-tetramethyldecane-1,10-diamine; dihydrobromide
SYSTEMATIC NAME: 4-[(4-hydroxyphenyl)methyl]phenol; N,N,N',N'-tetramethyldecane-1,10-diamine; dihydrobromide
MOLECULAR FORMULA: C27H46Br2N2O2
MOLECULAR WEIGHT: 590.47434
SMILES: CN(C)CCCCCCCCCCN(C)C.C1=CC(=CC=C1CC2=CC=C(C=C2)O)O.Br.Br
Structure:

CAS RN: 63979-77-1
CAS Name: 3-ethyl-1-(4-fluorophenyl)-6H-pyrazolo[3,4-c]pyridin-7-one
OPENEYE Name: 3-ethyl-1-(4-fluorophenyl)-6H-pyrazolo[3,4-c]pyridin-7-one
IUPAC Name: 3-ethyl-1-(4-fluorophenyl)-6H-pyrazolo[3,4-c]pyridin-7-one
SYSTEMATIC NAME: 3-ethyl-1-(4-fluorophenyl)-6H-pyrazolo[3,4-c]pyridin-7-one
MOLECULAR FORMULA: C14H12FN3O
MOLECULAR WEIGHT: 257.262983
SMILES: CCC1=NN(C2=C1C=CNC2=O)C3=CC=C(C=C3)F
Structure:

CAS RN: 63979-49-7
CAS Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide dihydrochloride
OPENEYE Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide dihydrochloride
IUPAC Name: 2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide dihydrochloride
SYSTEMATIC NAME: 2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide dihydrochloride
MOLECULAR FORMULA: C17H30Cl2N2O
MOLECULAR WEIGHT: 349.3389
SMILES: CCCC(C(=O)NC1=C(C=CC=C1C)C)N(CC)CC.Cl.Cl
Structure:

CAS RN: 63979-41-9
CAS Name: 6,7,8,9-tetrahydro-5H-carbazol-1-ylurea
OPENEYE Name: 6,7,8,9-tetrahydro-5H-carbazol-1-ylurea
IUPAC Name: 6,7,8,9-tetrahydro-5H-carbazol-1-ylurea
SYSTEMATIC NAME: 1-(6,7,8,9-tetrahydro-5H-carbazol-1-yl)urea
MOLECULAR FORMULA: C13H15N3O
MOLECULAR WEIGHT: 229.2777
SMILES: C1CCC2=C(C1)C3=C(N2)C(=CC=C3)NC(=O)N
Structure:

CAS RN: 63979-23-7
CAS Name: 2-[[4,6-bis[2-[[chloro(phenyl)methyl]-diethylammonio]ethylthio]-1,3,5-triazin-2-yl]thio]ethyl-[chloro(phenyl)methyl]-diethylammonium trichloride
OPENEYE Name: 2-[[4,6-bis[2-[[chloro(phenyl)methyl]-diethyl-ammonio]ethylsulfanyl]-1,3,5-triazin-2-yl]sulfanyl]ethyl-[chloro(phenyl)methyl]-diethyl-ammonium trichloride
IUPAC Name: 2-[[4,6-bis[2-[[chloro(phenyl)methyl]-diethylazaniumyl]ethylsulfanyl]-1,3,5-triazin-2-yl]sulfanyl]ethyl-[chloro(phenyl)methyl]-diethylazanium trichloride
SYSTEMATIC NAME: 2-[[4,6-bis[2-[[chloranyl(phenyl)methyl]-diethyl-azaniumyl]ethylsulfanyl]-1,3,5-triazin-2-yl]sulfanyl]ethyl-[chloranyl(phenyl)methyl]-diethyl-azanium trichloride
MOLECULAR FORMULA: C42H60Cl6N6S3
MOLECULAR WEIGHT: 957.879
SMILES: CC[N+](CC)(CCSC1=NC(=NC(=N1)SCC[N+](CC)(CC)C(C2=CC=CC=C2)Cl)SCC[N+](CC)(CC)C(C3=CC=CC=C3)Cl)C(C4=CC=CC=C4)Cl.[Cl-].[Cl-].[Cl-]
Structure:

http://ChemLookup.com Compounds

2012-02-27T16:35:00.001-08:00

CAS RN: 64054-15-5
CAS Name: 3'-oxo-1'-spiro[cyclopropane-1,2'-indole]carboxylic acid ethyl ester
OPENEYE Name: ethyl 3'-oxospiro[cyclopropane-1,2'-indoline]-1'-carboxylate
IUPAC Name: ethyl 3'-oxospiro[cyclopropane-1,2'-indole]-1'-carboxylate
SYSTEMATIC NAME: ethyl 3'-oxidanylidenespiro[cyclopropane-1,2'-indole]-1'-carboxylate
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: CCOC(=O)N1C2=CC=CC=C2C(=O)C13CC3
Structure:

CAS RN: 64054-05-3
CAS Name: 1'-acetyl-5'-methyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetyl-5'-methyl-spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetyl-5'-methylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoyl-5'-methyl-spiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C13H13NO2
MOLECULAR WEIGHT: 215.24782
SMILES: CC1=CC2=C(C=C1)N(C3(C2=O)CC3)C(=O)C
Structure:

CAS RN: 64053-88-9
CAS Name: 1'-acetyl-5'-methoxy-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetyl-5'-methoxy-spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetyl-5'-methoxyspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoyl-5'-methoxy-spiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: CC(=O)N1C2=C(C=C(C=C2)OC)C(=O)C13CC3
Structure:

CAS RN: 64053-86-7
CAS Name: 1'-methyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-methylspiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-methylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-methylspiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C11H11NO
MOLECULAR WEIGHT: 173.21114
SMILES: CN1C2=CC=CC=C2C(=O)C13CC3
Structure:

CAS RN: 64053-82-3
CAS Name: 3'-oxo-1'-spiro[cyclopropane-1,2'-indole]carboxaldehyde
OPENEYE Name: 3'-oxospiro[cyclopropane-1,2'-indoline]-1'-carbaldehyde
IUPAC Name: 3'-oxospiro[cyclopropane-1,2'-indole]-1'-carbaldehyde
SYSTEMATIC NAME: 3'-oxidanylidenespiro[cyclopropane-1,2'-indole]-1'-carbaldehyde
MOLECULAR FORMULA: C11H9NO2
MOLECULAR WEIGHT: 187.19466
SMILES: C1CC12C(=O)C3=CC=CC=C3N2C=O
Structure:

CAS RN: 64053-80-1
CAS Name: 1'-acetyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetylspiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoylspiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C12H11NO2
MOLECULAR WEIGHT: 201.22124
SMILES: CC(=O)N1C2=CC=CC=C2C(=O)C13CC3
Structure:

CAS RN: 64053-78-7
CAS Name: 3-spiro[1H-indole-2,1'-cyclopropane]one
OPENEYE Name: spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: spiro[1H-indole-2,1'-cyclopropane]-3-one
SYSTEMATIC NAME: spiro[1H-indole-2,1'-cyclopropane]-3-one
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: C1CC12C(=O)C3=CC=CC=C3N2
Structure:

CAS RN: 64047-40-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H15N
MOLECULAR WEIGHT: 305.3719
SMILES: CC1=CC2=C(C=C1)NC3=C2C=CC4=C5C=CC=C6C5=C(C=C6)C=C43
Structure:

CAS RN: 64047-38-7
CAS Name: trimethyl-[3-[(2-nitrophenyl)-oxomethoxy]phenyl]ammonium bromide
OPENEYE Name: trimethyl-[3-(2-nitrobenzoyl)oxyphenyl]ammonium bromide
IUPAC Name: trimethyl-[3-(2-nitrobenzoyl)oxyphenyl]azanium bromide
SYSTEMATIC NAME: trimethyl-[3-(2-nitrophenyl)carbonyloxyphenyl]azanium bromide
MOLECULAR FORMULA: C16H17BrN2O4
MOLECULAR WEIGHT: 381.22118
SMILES: C[N+](C)(C)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-].[Br-]
Structure:

CAS RN: 64047-32-1
CAS Name: (2,3-dimethylphenyl)arsonic acid
OPENEYE Name: (2,3-dimethylphenyl)arsonic acid
IUPAC Name: (2,3-dimethylphenyl)arsonic acid
SYSTEMATIC NAME: (2,3-dimethylphenyl)arsonic acid
MOLECULAR FORMULA: C8H11AsO3
MOLECULAR WEIGHT: 230.09274
SMILES: CC1=C(C(=CC=C1)[As](=O)(O)O)C
Structure:

CAS RN: 64047-26-3
CAS Name: N-[4-(diethylamino)-3,3-dimethylbutyl]carbamodithioate; mercury(2+); dihydrochloride
OPENEYE Name: mercuric N-[4-(diethylamino)-3,3-dimethyl-butyl]carbamodithioate dihydrochloride
IUPAC Name: N-[4-(diethylamino)-3,3-dimethylbutyl]carbamodithioate; mercury(2+); dihydrochloride
SYSTEMATIC NAME: N-[4-(diethylamino)-3,3-dimethyl-butyl]carbamodithioate; mercury(2+); dihydrochloride
MOLECULAR FORMULA: C22H48Cl2HgN4S4
MOLECULAR WEIGHT: 768.39932
SMILES: CCN(CC)CC(C)(C)CCNC(=S)[S-].CCN(CC)CC(C)(C)CCNC(=S)[S-].Cl.Cl.[Hg+2]
Structure:

CAS RN: 64046-68-0
CAS Name: calcium strontium tetraacetate
OPENEYE Name: calcium strontium tetraacetate
IUPAC Name: calcium strontium tetraacetate
SYSTEMATIC NAME: calcium strontium tetraethanoate
MOLECULAR FORMULA: C8H12CaO8Sr
MOLECULAR WEIGHT: 363.87408
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ca+2].[Sr+2]
Structure:

CAS RN: 64046-00-0
CAS Name: ammonium potassium selenium(2-)
OPENEYE Name: ammonium potassium selenium(2-)
IUPAC Name: azanium potassium selenium(2-)
SYSTEMATIC NAME: azanium potassium selenium(2-)
MOLECULAR FORMULA: H4KNSe
MOLECULAR WEIGHT: 136.09676
SMILES: [NH4+].[K+].[Se-2]
Structure:

CAS RN: 64044-05-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H34ClNO2
MOLECULAR WEIGHT: 379.96386
SMILES: CC1C2CCC3C(C2)(C1=O)CCC4C35CCCC4(CN6C5OCC6)C.Cl
Structure:

CAS RN: 64043-80-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@]12CCN([C@H]([C@H]1C)CC3=C2C=C(C=C3)O)C
Structure:

CAS RN: 64043-55-6
CAS Name: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetraiodohex-3-en-3-yl]phenol
OPENEYE Name: 4-[(Z)-1-ethyl-2-(4-hydroxyphenyl)-3,3,4,4-tetraiodo-but-1-enyl]phenol
IUPAC Name: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetraiodohex-3-en-3-yl]phenol
SYSTEMATIC NAME: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetrakis(iodanyl)hex-3-en-3-yl]phenol
MOLECULAR FORMULA: C18H16I4O2
MOLECULAR WEIGHT: 771.93632
SMILES: CC/C(=C(\C1=CC=C(C=C1)O)/C(C(I)I)(I)I)/C2=CC=C(C=C2)O
Structure:

CAS RN: 64043-30-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)O
Structure:

CAS RN: 64039-27-6
CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purine-6-thione hydrate
OPENEYE Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purine-6-thione hydrate
IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione hydrate
SYSTEMATIC NAME: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purine-6-thione hydrate
MOLECULAR FORMULA: C10H15N5O4S
MOLECULAR WEIGHT: 301.3222
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=S)N)CO)O.O
Structure:

CAS RN: 64038-47-7
CAS Name: calcium 2-[[butoxy(sulfanylidene)methyl]thio]acetate
OPENEYE Name: calcium 2-butoxycarbothioylsulfanylacetate
IUPAC Name: calcium 2-butoxycarbothioylsulfanylacetate
SYSTEMATIC NAME: calcium 2-butoxycarbothioylsulfanylethanoate
MOLECULAR FORMULA: C14H22CaO6S4
MOLECULAR WEIGHT: 454.65888
SMILES: CCCCOC(=S)SCC(=O)[O-].CCCCOC(=S)SCC(=O)[O-].[Ca+2]
Structure:

CAS RN: 64036-89-1
CAS Name: N,N-dimethylcarbamic acid (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) ester iodide
OPENEYE Name: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
IUPAC Name: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
SYSTEMATIC NAME: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
MOLECULAR FORMULA: C14H21IN2O2
MOLECULAR WEIGHT: 376.23321
SMILES: CN(C)C(=O)OC1=CC=CC2=C1[N+](CCC2)(C)C.[I-]
Structure:

CAS RN: 64026-55-7
CAS Name: 2-[[1-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]amino]acetamide
OPENEYE Name: 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]acetamide
IUPAC Name: 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]acetamide
SYSTEMATIC NAME: 2-[2-(2-oxidanylidenepyrrolidin-1-yl)ethanoylamino]ethanamide
MOLECULAR FORMULA: C8H13N3O3
MOLECULAR WEIGHT: 199.20712
SMILES: C1CC(=O)N(C1)CC(=O)NCC(=O)N
Structure:

CAS RN: 64024-08-4
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; urea
MOLECULAR FORMULA: C9H10N2O13Sb2
MOLECULAR WEIGHT: 597.7013
SMILES: [H+].[H+].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(=O)(N)N.[Sb+3].[Sb+3]
Structure:

CAS RN: 64023-90-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H27NO
MOLECULAR WEIGHT: 273.41308
SMILES: CCCCCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C
Structure:

CAS RN: 64023-89-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H25NO
MOLECULAR WEIGHT: 259.3865
SMILES: CCCCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C
Structure:

CAS RN: 64023-71-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@]12CCN([C@H]([C@@H]1C)CC3=C2C=C(C=C3)O)C
Structure:

CAS RN: 64019-15-4
CAS Name: 2-(2H-tetrazol-5-yl)-11-pyrido[2,1-b]quinazolinone
OPENEYE Name: 2-(2H-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
IUPAC Name: 2-(2H-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
SYSTEMATIC NAME: 2-(2H-1,2,3,4-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
MOLECULAR FORMULA: C13H8N6O
MOLECULAR WEIGHT: 264.24222
SMILES: C1=CC2=NC3=C(C=C(C=C3)C4=NNN=N4)C(=O)N2C=C1
Structure:

CAS RN: 64011-36-5
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 4-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC=C(C=C1)N.CC1=CC=C(C=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 64011-35-4
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 2-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC=CC=C1N.CC1=CC=CC=C1N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 64011-34-3
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 3-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC(=CC=C1)N.CC1=CC(=CC=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:

CAS RN: 64011-29-6
CAS Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
OPENEYE Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
IUPAC Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
SYSTEMATIC NAME: zinc 4-azanyl-2-(trifluoromethyl)benzenethiolate
MOLECULAR FORMULA: C14H10F6N2S2Zn
MOLECULAR WEIGHT: 449.772019
SMILES: C1=CC(=C(C=C1N)C(F)(F)F)[S-].C1=CC(=C(C=C1N)C(F)(F)F)[S-].[Zn+2]
Structure:

CAS RN: 64000-85-7
CAS Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
OPENEYE Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
IUPAC Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
SYSTEMATIC NAME: N-methyl-5-(methylamino)-3-oxidanylidene-2H-1,2,4-triazine-6-carboxamide
MOLECULAR FORMULA: C6H9N5O2
MOLECULAR WEIGHT: 183.16796
SMILES: CNC1=NC(=O)NN=C1C(=O)NC
Structure:

CAS RN: 63998-46-9
CAS Name: 1-(2-methyl-2,3-dihydrobenzofuran-5-yl)-1-propanone
OPENEYE Name: 1-(2-methyl-2,3-dihydrobenzofuran-5-yl)propan-1-one
IUPAC Name: 1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
SYSTEMATIC NAME: 1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
MOLECULAR FORMULA: C12H14O2
MOLECULAR WEIGHT: 190.23836
SMILES: CCC(=O)C1=CC2=C(C=C1)OC(C2)C
Structure:

CAS RN: 63998-38-9
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]-1-propanol hydrochloride
OPENEYE Name: 1-indan-5-yl-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
MOLECULAR FORMULA: C18H30ClNO3
MOLECULAR WEIGHT: 343.8887
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCCOCCOC.Cl
Structure: