CAS RN: 7564-26-3
CAS Name: 1-ethyl-8-[5-[(1-ethyl-8-quinolin-1-iumyl)oxy]pentoxy]quinolin-1-ium diiodide
OPENEYE Name: 1-ethyl-8-[5-(1-ethylquinolin-1-ium-8-yl)oxypentoxy]quinolin-1-ium diiodide
IUPAC Name: 1-ethyl-8-[5-(1-ethylquinolin-1-ium-8-yl)oxypentoxy]quinolin-1-ium diiodide
SYSTEMATIC NAME: 1-ethyl-8-[5-(1-ethylquinolin-1-ium-8-yl)oxypentoxy]quinolin-1-ium diiodide
MOLECULAR FORMULA: C27H32I2N2O2
MOLECULAR WEIGHT: 670.36412
SMILES: CC[N+]1=CC=CC2=C1C(=CC=C2)OCCCCCOC3=CC=CC4=C3[N+](=CC=C4)CC.[I-].[I-]
Structure:
CAS RN: 7563-86-2
CAS Name: 2-(4-methylphenyl)-2-(4-methyl-1-piperazinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(4-methylpiperazin-1-yl)-2-(p-tolyl)acetate
IUPAC Name: ethyl 2-(4-methylphenyl)-2-(4-methylpiperazin-1-yl)acetate
SYSTEMATIC NAME: ethyl 2-(4-methylphenyl)-2-(4-methylpiperazin-1-yl)ethanoate
MOLECULAR FORMULA: C16H24N2O2
MOLECULAR WEIGHT: 276.37396
SMILES: CCOC(=O)C(C1=CC=C(C=C1)C)N2CCN(CC2)C
Structure:
CAS RN: 7562-88-1
CAS Name: 4-methyl-3-(3-methylphenyl)-5-oxadiazol-3-iumolate
OPENEYE Name: 4-methyl-3-(m-tolyl)oxadiazol-3-ium-5-olate
IUPAC Name: 4-methyl-3-(3-methylphenyl)oxadiazol-3-ium-5-olate
SYSTEMATIC NAME: 4-methyl-3-(3-methylphenyl)-1,2,3-oxadiazol-3-ium-5-olate
MOLECULAR FORMULA: C10H10N2O2
MOLECULAR WEIGHT: 190.1986
SMILES: CC1=CC(=CC=C1)[N+]2=NOC(=C2C)[O-]
Structure:
CAS RN: 7561-48-0
CAS Name: 2-(4-methylphenyl)indene-1,3-dione
OPENEYE Name: 2-(p-tolyl)indane-1,3-dione
IUPAC Name: 2-(4-methylphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-(4-methylphenyl)indene-1,3-dione
MOLECULAR FORMULA: C16H12O2
MOLECULAR WEIGHT: 236.26528
SMILES: CC1=CC=C(C=C1)C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 14855-30-2
CAS Name: 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[[(2R,3R,4R,5S)-3-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)-2-oxanyl]oxy]-4-formyl-4-hydroxy-5-methyl-2-oxolanyl]oxy]-2,5,6-trihydroxycyclohexyl]guanidine; 2-[[oxo(pyridin-4-yl)
OPENEYE Name: 2-[(1S,2R,3R,4S,5R,6R)-2-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)tetrahydropyran-2-yl]oxy-4-formyl-4-hydroxy-5-methyl-tetrahydrofuran-2-yl]oxy-5-guanidino-3,4,6-trihydroxy-cyclohexyl]guanidine; 2-[2-(pyridine-4-ca
IUPAC Name: 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-formyl-4-hydroxy-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine; 2-[2-(pyridine-4-carbonyl
SYSTEMATIC NAME: 2-[(1R,2R,3S,4R,5R,6S)-3-[bis(azanyl)methylideneamino]-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-6-(hydroxymethyl)-3-(methylamino)-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-methanoyl-5-methyl-4-oxidanyl-oxolan-2-yl]oxy-2,5,6-tris(oxidanyl)cyclohexyl]guanidine; 2-(2-pyr
MOLECULAR FORMULA: C37H57N13O18
MOLECULAR WEIGHT: 971.92478
SMILES: C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O.C1=CN=CC=C1C(=O)NNCC(=O)O.C1=CN=CC=C1C(=O)NNCC(=O)O
Structure:
CAS RN: 7551-29-3
CAS Name: 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[[(2R,3R,4R,5S)-3-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)-2-oxanyl]oxy]-4-formyl-4-hydroxy-5-methyl-2-oxolanyl]oxy]-2,5,6-trihydroxycyclohexyl]guanidine; 2-[[oxo(pyridin-4-yl)
OPENEYE Name: 2-[(1S,2R,3R,4S,5R,6R)-2-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)tetrahydropyran-2-yl]oxy-4-formyl-4-hydroxy-5-methyl-tetrahydrofuran-2-yl]oxy-5-guanidino-3,4,6-trihydroxy-cyclohexyl]guanidine; 2-[2-(pyridine-4-ca
IUPAC Name: 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-formyl-4-hydroxy-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine; 2-[2-(pyridine-4-carbonyl
SYSTEMATIC NAME: 2-[(1R,2R,3S,4R,5R,6S)-3-[bis(azanyl)methylideneamino]-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-6-(hydroxymethyl)-3-(methylamino)-4,5-bis(oxidanyl)oxan-2-yl]oxy-4-methanoyl-5-methyl-4-oxidanyl-oxolan-2-yl]oxy-2,5,6-tris(oxidanyl)cyclohexyl]guanidine; 2-(2-pyr
MOLECULAR FORMULA: C37H57N13O18
MOLECULAR WEIGHT: 971.92478
SMILES: C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O.C1=CN=CC=C1C(=O)NNCC(=O)O.C1=CN=CC=C1C(=O)NNCC(=O)O
Structure:
CAS RN: 7550-31-4
CAS Name: 2-phenyl-2-(1-piperidinyl)acetohydrazide
OPENEYE Name: 2-phenyl-2-(1-piperidyl)acetohydrazide
IUPAC Name: 2-phenyl-2-piperidin-1-ylacetohydrazide
SYSTEMATIC NAME: 2-phenyl-2-piperidin-1-yl-ethanehydrazide
MOLECULAR FORMULA: C13H19N3O
MOLECULAR WEIGHT: 233.30946
SMILES: C1CCN(CC1)C(C2=CC=CC=C2)C(=O)NN
Structure:
CAS RN: 7550-29-0
CAS Name: 2-(4-chlorophenyl)-2-(4-methyl-1-piperazinyl)ethanol
OPENEYE Name: 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethanol
IUPAC Name: 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethanol
SYSTEMATIC NAME: 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethanol
MOLECULAR FORMULA: C13H19ClN2O
MOLECULAR WEIGHT: 254.75576
SMILES: CN1CCN(CC1)C(CO)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 7550-28-9
CAS Name: 2-(4-chlorophenyl)-2-(1-piperidinyl)ethanol
OPENEYE Name: 2-(4-chlorophenyl)-2-(1-piperidyl)ethanol
IUPAC Name: 2-(4-chlorophenyl)-2-piperidin-1-ylethanol
SYSTEMATIC NAME: 2-(4-chlorophenyl)-2-piperidin-1-yl-ethanol
MOLECULAR FORMULA: C13H18ClNO
MOLECULAR WEIGHT: 239.74112
SMILES: C1CCN(CC1)C(CO)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 7550-27-8
CAS Name: 2-(4-ethoxyphenyl)-2-(4-methyl-1-piperazinyl)ethanol
OPENEYE Name: 2-(4-ethoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanol
IUPAC Name: 2-(4-ethoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanol
SYSTEMATIC NAME: 2-(4-ethoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanol
MOLECULAR FORMULA: C15H24N2O2
MOLECULAR WEIGHT: 264.36326
SMILES: CCOC1=CC=C(C=C1)C(CO)N2CCN(CC2)C
Structure:
CAS RN: 7550-24-5
CAS Name: 2-(4-methylphenyl)-2-(4-phenyl-1-piperazinyl)ethanol
OPENEYE Name: 2-(4-phenylpiperazin-1-yl)-2-(p-tolyl)ethanol
IUPAC Name: 2-(4-methylphenyl)-2-(4-phenylpiperazin-1-yl)ethanol
SYSTEMATIC NAME: 2-(4-methylphenyl)-2-(4-phenylpiperazin-1-yl)ethanol
MOLECULAR FORMULA: C19H24N2O
MOLECULAR WEIGHT: 296.40666
SMILES: CC1=CC=C(C=C1)C(CO)N2CCN(CC2)C3=CC=CC=C3
Structure:
CAS RN: 7550-23-4
CAS Name: 2-(4-methylphenyl)-2-(1-piperidinyl)ethanol
OPENEYE Name: 2-(1-piperidyl)-2-(p-tolyl)ethanol
IUPAC Name: 2-(4-methylphenyl)-2-piperidin-1-ylethanol
SYSTEMATIC NAME: 2-(4-methylphenyl)-2-piperidin-1-yl-ethanol
MOLECULAR FORMULA: C14H21NO
MOLECULAR WEIGHT: 219.32264
SMILES: CC1=CC=C(C=C1)C(CO)N2CCCCC2
Structure:
CAS RN: 7550-17-6
CAS Name: 2-(4-chlorophenyl)-2-(4-methyl-1-piperazinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)acetate
IUPAC Name: ethyl 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)acetate
SYSTEMATIC NAME: ethyl 2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethanoate
MOLECULAR FORMULA: C15H21ClN2O2
MOLECULAR WEIGHT: 296.79244
SMILES: CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C
Structure:
CAS RN: 7550-11-0
CAS Name: 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(4-methyl-1,4-diazepan-1-yl)-2-(p-tolyl)acetate
IUPAC Name: ethyl 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)acetate
SYSTEMATIC NAME: ethyl 2-(4-methyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)ethanoate
MOLECULAR FORMULA: C17H26N2O2
MOLECULAR WEIGHT: 290.40054
SMILES: CCOC(=O)C(C1=CC=C(C=C1)C)N2CCCN(CC2)C
Structure:
CAS RN: 7550-10-9
CAS Name: 2-(4-methylphenyl)-2-(4-morpholinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-morpholino-2-(p-tolyl)acetate
IUPAC Name: ethyl 2-(4-methylphenyl)-2-morpholin-4-ylacetate
SYSTEMATIC NAME: ethyl 2-(4-methylphenyl)-2-morpholin-4-yl-ethanoate
MOLECULAR FORMULA: C15H21NO3
MOLECULAR WEIGHT: 263.33214
SMILES: CCOC(=O)C(C1=CC=C(C=C1)C)N2CCOCC2
Structure:
CAS RN: 7550-08-5
CAS Name: 2-(4-methylphenyl)-2-(1-piperidinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(1-piperidyl)-2-(p-tolyl)acetate
IUPAC Name: ethyl 2-(4-methylphenyl)-2-piperidin-1-ylacetate
SYSTEMATIC NAME: ethyl 2-(4-methylphenyl)-2-piperidin-1-yl-ethanoate
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 261.35932
SMILES: CCOC(=O)C(C1=CC=C(C=C1)C)N2CCCCC2
Structure:
CAS RN: 7550-06-3
CAS Name: 2-phenyl-2-(1-piperidinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-phenyl-2-(1-piperidyl)acetate
IUPAC Name: ethyl 2-phenyl-2-piperidin-1-ylacetate
SYSTEMATIC NAME: ethyl 2-phenyl-2-piperidin-1-yl-ethanoate
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: CCOC(=O)C(C1=CC=CC=C1)N2CCCCC2
Structure:
CAS RN: 7548-69-8
CAS Name: 5-ethyl-5-(2-hydroxy-2-methylbutyl)-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-ethyl-5-(2-hydroxy-2-methyl-butyl)hexahydropyrimidine-2,4,6-trione
IUPAC Name: 5-ethyl-5-(2-hydroxy-2-methylbutyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-ethyl-5-(2-methyl-2-oxidanyl-butyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C11H18N2O4
MOLECULAR WEIGHT: 242.27162
SMILES: CCC1(C(=O)NC(=O)NC1=O)CC(C)(CC)O
Structure:
CAS RN: 7548-66-5
CAS Name: 5-ethyl-5-[2-hydroxy-2-(3-pyridinyl)ethyl]-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-ethyl-5-[2-hydroxy-2-(3-pyridyl)ethyl]hexahydropyrimidine-2,4,6-trione
IUPAC Name: 5-ethyl-5-(2-hydroxy-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-ethyl-5-(2-oxidanyl-2-pyridin-3-yl-ethyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C13H15N3O4
MOLECULAR WEIGHT: 277.2759
SMILES: CCC1(C(=O)NC(=O)NC1=O)CC(C2=CN=CC=C2)O
Structure:
CAS RN: 7548-46-1
CAS Name: (8R,9S,13S,14S)-17-(2-bromoethynyl)-3,17-dimethoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
OPENEYE Name: (8R,9S,13S,14S)-17-(2-bromoethynyl)-3,17-dimethoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
IUPAC Name: (8R,9S,13S,14S)-17-(2-bromoethynyl)-3,17-dimethoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: (8R,9S,13S,14S)-17-(2-bromanylethynyl)-3,17-dimethoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C22H27BrO2
MOLECULAR WEIGHT: 403.35258
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#CBr)OC)CCC4=C3C=CC(=C4)OC
Structure:
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