CAS RN: 63114-16-9
CAS Name: 1-[3-(1-piperidinyl)propyl]piperidine dihydrochloride
OPENEYE Name: 1-[3-(1-piperidyl)propyl]piperidine dihydrochloride
IUPAC Name: 1-(3-piperidin-1-ylpropyl)piperidine dihydrochloride
SYSTEMATIC NAME: 1-(3-piperidin-1-ylpropyl)piperidine dihydrochloride
MOLECULAR FORMULA: C13H28Cl2N2
MOLECULAR WEIGHT: 283.28082
SMILES: C1CCN(CC1)CCCN2CCCCC2.Cl.Cl
Structure:
CAS RN: 63108-07-6
CAS Name: 5-phenyl-4,6,11-trithia-1-aza-5-silabicyclo[3.3.3]undecane
OPENEYE Name: 5-phenyl-4,6,11-trithia-1-aza-5-silabicyclo[3.3.3]undecane
IUPAC Name: 5-phenyl-4,6,11-trithia-1-aza-5-silabicyclo[3.3.3]undecane
SYSTEMATIC NAME: 5-phenyl-4,6,11-trithia-1-aza-5-silabicyclo[3.3.3]undecane
MOLECULAR FORMULA: C12H17NS3Si
MOLECULAR WEIGHT: 299.55058
SMILES: C1CS[Si]2(SCCN1CCS2)C3=CC=CC=C3
Structure:
CAS RN: 63103-76-4
CAS Name: [2-methylpropyl(phenyl)phosphoryl]benzene
OPENEYE Name: [isobutyl(phenyl)phosphoryl]benzene
IUPAC Name: [2-methylpropyl(phenyl)phosphoryl]benzene
SYSTEMATIC NAME: [2-methylpropyl(phenyl)phosphoryl]benzene
MOLECULAR FORMULA: C16H19OP
MOLECULAR WEIGHT: 258.295221
SMILES: CC(C)CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 63098-95-3
CAS Name: 1-ethyl-1-phenylurea
OPENEYE Name: 1-ethyl-1-phenyl-urea
IUPAC Name: 1-ethyl-1-phenylurea
SYSTEMATIC NAME: 1-ethyl-1-phenyl-urea
MOLECULAR FORMULA: C9H12N2O
MOLECULAR WEIGHT: 164.20438
SMILES: CCN(C1=CC=CC=C1)C(=O)N
Structure:
CAS RN: 63094-34-8
CAS Name: 2-chloro-11-oxo-8-pyrido[2,1-b]quinazolinecarboxylic acid
OPENEYE Name: 2-chloro-11-oxo-pyrido[2,1-b]quinazoline-8-carboxylic acid
IUPAC Name: 2-chloro-11-oxopyrido[2,1-b]quinazoline-8-carboxylic acid
SYSTEMATIC NAME: 2-chloranyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxylic acid
MOLECULAR FORMULA: C13H7ClN2O3
MOLECULAR WEIGHT: 274.65928
SMILES: C1=CC2=C(C=C1Cl)C(=O)N3C=C(C=CC3=N2)C(=O)O
Structure:
CAS RN: 63094-33-7
CAS Name: 2-methyl-11-oxo-8-pyrido[2,1-b]quinazolinecarboxylic acid
OPENEYE Name: 2-methyl-11-oxo-pyrido[2,1-b]quinazoline-8-carboxylic acid
IUPAC Name: 2-methyl-11-oxopyrido[2,1-b]quinazoline-8-carboxylic acid
SYSTEMATIC NAME: 2-methyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxylic acid
MOLECULAR FORMULA: C14H10N2O3
MOLECULAR WEIGHT: 254.2408
SMILES: CC1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)C(=O)O
Structure:
CAS RN: 63081-06-1
CAS Name: 9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazole
OPENEYE Name: 9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazole
IUPAC Name: 9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazole
SYSTEMATIC NAME: 9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazole
MOLECULAR FORMULA: C17H14N2O
MOLECULAR WEIGHT: 262.30586
SMILES: CC1=C2C=CN=CC2=CC3=C1NC4=C3C=C(C=C4)OC
Structure:
CAS RN: 63080-67-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H23NO3
MOLECULAR WEIGHT: 313.39082
SMILES: CN1CCC2=CC(=C(C3=C2[C@H]1C[C@@H]4C3=CC(=O)CC4)OC)OC
Structure:
CAS RN: 63080-58-0
CAS Name: 5,6-dimethoxy-1-methyl-1'-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,2'-cyclohexane]one
OPENEYE Name: 5,6-dimethoxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,2'-cyclohexane]-1'-one
IUPAC Name: 5,6-dimethoxy-1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,2'-cyclohexane]-1'-one
SYSTEMATIC NAME: 5,6-dimethoxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,2'-cyclohexane]-1'-one
MOLECULAR FORMULA: C20H27NO3
MOLECULAR WEIGHT: 329.43328
SMILES: CN1CCC2=CC(=C(C3=C2C1CCC34CCCCC4=O)OC)OC
Structure:
CAS RN: 63080-49-9
CAS Name: 2-(5,6-dimethoxy-1-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]yl)acetic acid methyl ester
OPENEYE Name: methyl 2-(5,6-dimethoxyspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-1-yl)acetate
IUPAC Name: methyl 2-(5,6-dimethoxyspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-1-yl)acetate
SYSTEMATIC NAME: methyl 2-(5,6-dimethoxyspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-1-yl)ethanoate
MOLECULAR FORMULA: C21H29NO4
MOLECULAR WEIGHT: 359.45926
SMILES: COC1=C(C2=C3C(CCC24CCCC4)N(CCC3=C1)CC(=O)OC)OC
Structure:
CAS RN: 63080-48-8
CAS Name: acetic acid (6-acetyloxy-1-methyl-5-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]yl) ester
OPENEYE Name: (6-acetoxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5-yl) acetate
IUPAC Name: (6-acetyloxy-1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5-yl) acetate
SYSTEMATIC NAME: (6-acetyloxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5-yl) ethanoate
MOLECULAR FORMULA: C21H27NO4
MOLECULAR WEIGHT: 357.44338
SMILES: CC(=O)OC1=C(C2=C3C(CCC24CCCC4)N(CCC3=C1)C)OC(=O)C
Structure:
CAS RN: 63080-47-7
CAS Name: 1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5,6-diol
OPENEYE Name: 1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5,6-diol
IUPAC Name: 1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5,6-diol
SYSTEMATIC NAME: 1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane]-5,6-diol
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CN1CCC2=CC(=C(C3=C2C1CCC34CCCC4)O)O
Structure:
CAS RN: 63080-46-6
CAS Name: 5,6-dimethoxy-1-(phenylmethyl)spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
OPENEYE Name: 1-benzyl-5,6-dimethoxy-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
IUPAC Name: 1-benzyl-5,6-dimethoxyspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
SYSTEMATIC NAME: 5,6-dimethoxy-1-(phenylmethyl)spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
MOLECULAR FORMULA: C25H32ClNO2
MOLECULAR WEIGHT: 413.98008
SMILES: COC1=C(C2=C3C(CCC24CCCC4)N(CCC3=C1)CC5=CC=CC=C5)OC.Cl
Structure:
CAS RN: 63080-45-5
CAS Name: 5,6-dimethoxy-1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
OPENEYE Name: 5,6-dimethoxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
IUPAC Name: 5,6-dimethoxy-1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
SYSTEMATIC NAME: 5,6-dimethoxy-1-methyl-spiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,1'-cyclopentane] hydrochloride
MOLECULAR FORMULA: C19H28ClNO2
MOLECULAR WEIGHT: 337.88412
SMILES: CN1CCC2=CC(=C(C3=C2C1CCC34CCCC4)OC)OC.Cl
Structure:
CAS RN: 63080-44-4
CAS Name: 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane] hydrochloride
OPENEYE Name: 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane] hydrochloride
IUPAC Name: 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane] hydrochloride
SYSTEMATIC NAME: 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane] hydrochloride
MOLECULAR FORMULA: C18H26ClNO2
MOLECULAR WEIGHT: 323.85754
SMILES: COC1=C(C2=C3C(CCC24CCCC4)NCCC3=C1)OC.Cl
Structure:
CAS RN: 63077-40-7
CAS Name: 2-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl]guanidine; sulfuric acid
OPENEYE Name: 2-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl]guanidine; sulfuric acid
IUPAC Name: 2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]guanidine; sulfuric acid
SYSTEMATIC NAME: 2-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]guanidine; sulfuric acid
MOLECULAR FORMULA: C20H32N14O8S
MOLECULAR WEIGHT: 628.62208
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN=C(N)N.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN=C(N)N.OS(=O)(=O)O
Structure:
CAS RN: 63074-37-3
CAS Name: 3-methoxy-5,6-bis(4-methylphenyl)-1,2,4-triazine
OPENEYE Name: 3-methoxy-5,6-bis(p-tolyl)-1,2,4-triazine
IUPAC Name: 3-methoxy-5,6-bis(4-methylphenyl)-1,2,4-triazine
SYSTEMATIC NAME: 3-methoxy-5,6-bis(4-methylphenyl)-1,2,4-triazine
MOLECULAR FORMULA: C18H17N3O
MOLECULAR WEIGHT: 291.34708
SMILES: CC1=CC=C(C=C1)C2=C(N=NC(=N2)OC)C3=CC=C(C=C3)C
Structure:
CAS RN: 63071-88-5
CAS Name: 5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
OPENEYE Name: 5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
IUPAC Name: 5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
SYSTEMATIC NAME: 5-[3,3,3-tris(fluoranyl)propyl]-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
MOLECULAR FORMULA: C9H16F3NO3Si
MOLECULAR WEIGHT: 271.30895
SMILES: C1CO[Si]2(OCCN1CCO2)CCC(F)(F)F
Structure:
CAS RN: 63071-87-4
CAS Name: 5-(3-fluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
OPENEYE Name: 5-(3-fluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
IUPAC Name: 5-(3-fluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
SYSTEMATIC NAME: 5-(3-fluoranylpropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
MOLECULAR FORMULA: C9H18FNO3Si
MOLECULAR WEIGHT: 235.328023
SMILES: C1CO[Si]2(OCCN1CCO2)CCCF
Structure:
CAS RN: 63065-25-8
CAS Name: 1,6-dimethyl-3-pyridin-1-iumcarboxylic acid methyl ester iodide
OPENEYE Name: methyl 1,6-dimethylpyridin-1-ium-3-carboxylate iodide
IUPAC Name: methyl 1,6-dimethylpyridin-1-ium-3-carboxylate iodide
SYSTEMATIC NAME: methyl 1,6-dimethylpyridin-1-ium-3-carboxylate iodide
MOLECULAR FORMULA: C9H12INO2
MOLECULAR WEIGHT: 293.10155
SMILES: CC1=[N+](C=C(C=C1)C(=O)OC)C.[I-]
Structure:
CAS RN: 63058-04-8
CAS Name: 2-acetyloxybenzoic acid; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
OPENEYE Name: 2-acetoxybenzoic acid; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
IUPAC Name: 2-acetyloxybenzoic acid; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
SYSTEMATIC NAME: 2-acetyloxybenzoic acid; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
MOLECULAR FORMULA: C16H25NO9
MOLECULAR WEIGHT: 375.371
SMILES: CC(=O)OC1=CC=CC=C1C(=O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
Structure:
CAS RN: 63041-78-1
CAS Name: 5-methyl-1,2-dihydrobenzo[j]aceanthrylene
OPENEYE Name: 5-methyl-1,2-dihydrobenzo[j]aceanthrylene
IUPAC Name: 5-methyl-1,2-dihydrobenzo[j]aceanthrylene
SYSTEMATIC NAME: 5-methyl-1,2-dihydrobenzo[j]aceanthrylene
MOLECULAR FORMULA: C21H16
MOLECULAR WEIGHT: 268.35174
SMILES: CC1=C2C=C3C(=C4C2=C(CC4)C=C1)C=CC5=CC=CC=C53
Structure:
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