Tuesday, July 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 8-methoxy-2,4-dimethyl-pyrrolo[3,4-c]quinoline-1,3-dione
CAS Name: 8-methoxy-2,4-dimethylpyrrolo[3,4-c]quinoline-1,3-dione
IUPAC NAME: 8-methoxy-2,4-dimethylpyrrolo[3,4-c]quinoline-1,3-dione
SYSTEMATIC NAME: 8-methoxy-2,4-dimethyl-pyrrolo[3,4-c]quinoline-1,3-dione
MOLECULAR FORMULA: C14H12N2O3
MOLECULAR WEIGHT: 256.25668
SMILES: CC1=C2C(=C3C=C(C=CC3=N1)OC)C(=O)N(C2=O)C
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Product OPENEYE NAME: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1-azido-piperazin-1-ium-1-yl]-phenyl-methanone
CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-azido-1-piperazin-1-iumyl]-phenylmethanone
IUPAC NAME: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1-azidopiperazin-1-ium-1-yl]-phenylmethanone
SYSTEMATIC NAME: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1-azido-piperazin-1-ium-1-yl]-phenyl-methanone
MOLECULAR FORMULA: C21H23N8O3+
MOLECULAR WEIGHT: 435.45912
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CC[N+](CC3)(C(=O)C4=CC=CC=C4)N=[N+]=[N-])N)OC
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-6-(4-aminophenyl)hexan-1-one hydrochloride
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-6-(4-aminophenyl)-1-hexanone hydrochloride
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-6-(4-aminophenyl)hexan-1-one hydrochloride
SYSTEMATIC NAME: 6-(4-aminophenyl)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]hexan-1-one hydrochloride
MOLECULAR FORMULA: C26H35ClN6O3
MOLECULAR WEIGHT: 515.0475
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCCC4=CC=C(C=C4)N)N)OC.Cl
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-6-(4-aminophenyl)hexan-1-one
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-6-(4-aminophenyl)-1-hexanone
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-6-(4-aminophenyl)hexan-1-one
SYSTEMATIC NAME: 6-(4-aminophenyl)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]hexan-1-one
MOLECULAR FORMULA: C26H34N6O3
MOLECULAR WEIGHT: 478.58656
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCCC4=CC=C(C=C4)N)N)OC
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4-(4-azidophenyl)butan-1-one
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-4-(4-azidophenyl)-1-butanone
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-4-(4-azidophenyl)butan-1-one
SYSTEMATIC NAME: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4-(4-azidophenyl)butan-1-one
MOLECULAR FORMULA: C24H28N8O3
MOLECULAR WEIGHT: 476.53092
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCC4=CC=C(C=C4)N=[N+]=[N-])N)OC
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-2-yl]-4-(4-aminophenyl)pentan-1-one
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-2-piperazinyl]-4-(4-aminophenyl)-1-pentanone
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-2-yl]-4-(4-aminophenyl)pentan-1-one
SYSTEMATIC NAME: 4-(4-aminophenyl)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-2-yl]pentan-1-one
MOLECULAR FORMULA: C25H32N6O3
MOLECULAR WEIGHT: 464.55998
SMILES: CC(CCC(=O)C1CN(CCN1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C4=CC=C(C=C4)N
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(4-azidophenyl)pentan-1-one
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-5-(4-azidophenyl)-1-pentanone
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-5-(4-azidophenyl)pentan-1-one
SYSTEMATIC NAME: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(4-azidophenyl)pentan-1-one
MOLECULAR FORMULA: C25H30N8O3
MOLECULAR WEIGHT: 490.5575
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCC4=CC=C(C=C4)N=[N+]=[N-])N)OC
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(4-nitrophenyl)pentan-1-one hydrochloride
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-5-(4-nitrophenyl)-1-pentanone hydrochloride
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-5-(4-nitrophenyl)pentan-1-one hydrochloride
SYSTEMATIC NAME: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(4-nitrophenyl)pentan-1-one hydrochloride
MOLECULAR FORMULA: C25H31ClN6O5
MOLECULAR WEIGHT: 531.00384
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCC4=CC=C(C=C4)[N+](=O)[O-])N)OC.Cl
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4-(4-aminophenyl)butan-1-one hydrochloride
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-4-(4-aminophenyl)-1-butanone hydrochloride
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-4-(4-aminophenyl)butan-1-one hydrochloride
SYSTEMATIC NAME: 4-(4-aminophenyl)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]butan-1-one hydrochloride
MOLECULAR FORMULA: C24H31ClN6O3
MOLECULAR WEIGHT: 486.99434
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCC4=CC=C(C=C4)N)N)OC.Cl
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-(4-aminophenyl)pentan-1-one hydrochloride
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-5-(4-aminophenyl)-1-pentanone hydrochloride
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-5-(4-aminophenyl)pentan-1-one hydrochloride
SYSTEMATIC NAME: 5-(4-aminophenyl)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]pentan-1-one hydrochloride
MOLECULAR FORMULA: C25H33ClN6O3
MOLECULAR WEIGHT: 501.02092
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCC4=CC=C(C=C4)N)N)OC.Cl
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Product OPENEYE NAME: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-6-(4-azidophenyl)hexan-1-one
CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-6-(4-azidophenyl)-1-hexanone
IUPAC NAME: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-6-(4-azidophenyl)hexan-1-one
SYSTEMATIC NAME: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-6-(4-azidophenyl)hexan-1-one
MOLECULAR FORMULA: C26H32N8O3
MOLECULAR WEIGHT: 504.58408
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)CCCCCC4=CC=C(C=C4)N=[N+]=[N-])N)OC
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Product OPENEYE NAME: ethanol; 1,2,3,4-tetrahydroquinoline
CAS Name: ethanol; 1,2,3,4-tetrahydroquinoline
IUPAC NAME: ethanol; 1,2,3,4-tetrahydroquinoline
SYSTEMATIC NAME: ethanol; 1,2,3,4-tetrahydroquinoline
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CCO.C1CC2=CC=CC=C2NC1
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Product OPENEYE NAME: ethane; 1,2,3,4-tetrahydroquinolin-3-ol
CAS Name: ethane; 1,2,3,4-tetrahydroquinolin-3-ol
IUPAC NAME: ethane; 1,2,3,4-tetrahydroquinolin-3-ol
SYSTEMATIC NAME: ethane; 1,2,3,4-tetrahydroquinolin-3-ol
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CC.C1C(CNC2=CC=CC=C21)O
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Product OPENEYE NAME: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-propan-1-one
CAS Name: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-1-propanone
IUPAC NAME: 1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methylpropan-1-one
SYSTEMATIC NAME: 1-[(4Z)-6-chloranyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]-2-methyl-propan-1-one
MOLECULAR FORMULA: C13H15ClN2O2
MOLECULAR WEIGHT: 266.7234
SMILES: CC(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Cl
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Product OPENEYE NAME: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]ethanone
CAS Name: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]ethanone
IUPAC NAME: 1-[(4Z)-6-bromo-4-hydroxyimino-2,3-dihydroquinolin-1-yl]ethanone
SYSTEMATIC NAME: 1-[(4Z)-6-bromanyl-4-hydroxyimino-2,3-dihydroquinolin-1-yl]ethanone
MOLECULAR FORMULA: C11H11BrN2O2
MOLECULAR WEIGHT: 283.12124
SMILES: CC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Br
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Product OPENEYE NAME: hexane; 1,2,3,4-tetrahydroquinoline
CAS Name: hexane; 1,2,3,4-tetrahydroquinoline
IUPAC NAME: hexane; 1,2,3,4-tetrahydroquinoline
SYSTEMATIC NAME: hexane; 1,2,3,4-tetrahydroquinoline
MOLECULAR FORMULA: C15H25N
MOLECULAR WEIGHT: 219.3657
SMILES: CCCCCC.C1CC2=CC=CC=C2NC1
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Product OPENEYE NAME: 1,4-dihydroquinoline; ethanol
CAS Name: 1,4-dihydroquinoline; ethanol
IUPAC NAME: 1,4-dihydroquinoline; ethanol
SYSTEMATIC NAME: 1,4-dihydroquinoline; ethanol
MOLECULAR FORMULA: C11H15NO
MOLECULAR WEIGHT: 177.2429
SMILES: CCO.C1C=CNC2=CC=CC=C21
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Product OPENEYE NAME: [(Z)-1-(2-quinolyl)ethylideneamino]azanide
CAS Name: [(Z)-1-(2-quinolinyl)ethylideneamino]azanide
IUPAC NAME: [(Z)-1-quinolin-2-ylethylideneamino]azanide
SYSTEMATIC NAME: [(Z)-1-quinolin-2-ylethylideneamino]azanide
MOLECULAR FORMULA: C11H10N3-
MOLECULAR WEIGHT: 184.2172
SMILES: C/C(=N/[NH-])/C1=NC2=CC=CC=C2C=C1
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