Tuesday, September 4, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(1-benzylpiperidine-4-carbonyl)-1H-indole-3-carbaldehyde
CAS Name: 2-[oxo-[1-(phenylmethyl)-4-piperidinyl]methyl]-1H-indole-3-carboxaldehyde
IUPAC NAME: 2-(1-benzylpiperidine-4-carbonyl)-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 2-[1-(phenylmethyl)piperidin-4-yl]carbonyl-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C22H22N2O2
MOLECULAR WEIGHT: 346.42228
SMILES: C1CN(CCC1C(=O)C2=C(C3=CC=CC=C3N2)C=O)CC4=CC=CC=C4
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Product OPENEYE NAME: (1-benzyl-4-piperidyl)-[3-(hydroxymethyl)-1H-indol-2-yl]methanone
CAS Name: [3-(hydroxymethyl)-1H-indol-2-yl]-[1-(phenylmethyl)-4-piperidinyl]methanone
IUPAC NAME: (1-benzylpiperidin-4-yl)-[3-(hydroxymethyl)-1H-indol-2-yl]methanone
SYSTEMATIC NAME: [3-(hydroxymethyl)-1H-indol-2-yl]-[1-(phenylmethyl)piperidin-4-yl]methanone
MOLECULAR FORMULA: C22H24N2O2
MOLECULAR WEIGHT: 348.43816
SMILES: C1CN(CCC1C(=O)C2=C(C3=CC=CC=C3N2)CO)CC4=CC=CC=C4
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Product OPENEYE NAME: 2-(1-acetylpiperidine-4-carbonyl)-1H-indole-3-carbaldehyde
CAS Name: 2-[(1-acetyl-4-piperidinyl)-oxomethyl]-1H-indole-3-carboxaldehyde
IUPAC NAME: 2-(1-acetylpiperidine-4-carbonyl)-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 2-(1-ethanoylpiperidin-4-yl)carbonyl-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: CC(=O)N1CCC(CC1)C(=O)C2=C(C3=CC=CC=C3N2)C=O
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Product OPENEYE NAME: 1-[4-[3-(methoxymethyl)-1H-indole-2-carbonyl]-1-piperidyl]ethanone
CAS Name: 1-[4-[[3-(methoxymethyl)-1H-indol-2-yl]-oxomethyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[3-(methoxymethyl)-1H-indole-2-carbonyl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[[3-(methoxymethyl)-1H-indol-2-yl]carbonyl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C18H22N2O3
MOLECULAR WEIGHT: 314.37888
SMILES: CC(=O)N1CCC(CC1)C(=O)C2=C(C3=CC=CC=C3N2)COC
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Product OPENEYE NAME: 1-[4-[3-(hydroxymethyl)-1H-indole-2-carbonyl]-1-piperidyl]ethanone
CAS Name: 1-[4-[[3-(hydroxymethyl)-1H-indol-2-yl]-oxomethyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[3-(hydroxymethyl)-1H-indole-2-carbonyl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[[3-(hydroxymethyl)-1H-indol-2-yl]carbonyl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C17H20N2O3
MOLECULAR WEIGHT: 300.3523
SMILES: CC(=O)N1CCC(CC1)C(=O)C2=C(C3=CC=CC=C3N2)CO
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Product OPENEYE NAME: 2-(1-hydroxyethyl)-1H-indole-3-carbaldehyde
CAS Name: 2-(1-hydroxyethyl)-1H-indole-3-carboxaldehyde
IUPAC NAME: 2-(1-hydroxyethyl)-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 2-(1-hydroxyethyl)-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C11H11NO2
MOLECULAR WEIGHT: 189.21054
SMILES: CC(C1=C(C2=CC=CC=C2N1)C=O)O
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Product OPENEYE NAME: 2-[hydroxy(phenyl)methyl]-1H-indole-3-carbaldehyde
CAS Name: 2-[hydroxy(phenyl)methyl]-1H-indole-3-carboxaldehyde
IUPAC NAME: 2-[hydroxy(phenyl)methyl]-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 2-[oxidanyl(phenyl)methyl]-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C16H13NO2
MOLECULAR WEIGHT: 251.27992
SMILES: C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3N2)C=O)O
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Product OPENEYE NAME: 2-[(1-benzyl-4-piperidyl)-hydroxy-methyl]-1H-indole-3-carbaldehyde
CAS Name: 2-[hydroxy-[1-(phenylmethyl)-4-piperidinyl]methyl]-1H-indole-3-carboxaldehyde
IUPAC NAME: 2-[(1-benzylpiperidin-4-yl)-hydroxymethyl]-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 2-[oxidanyl-[1-(phenylmethyl)piperidin-4-yl]methyl]-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C22H24N2O2
MOLECULAR WEIGHT: 348.43816
SMILES: C1CN(CCC1C(C2=C(C3=CC=CC=C3N2)C=O)O)CC4=CC=CC=C4
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Product OPENEYE NAME: methyl 1-benzyl-4-methoxy-2,3-dimethyl-pyrrolo[2,3-b]pyridine-5-carboxylate
CAS Name: 4-methoxy-2,3-dimethyl-1-(phenylmethyl)-5-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-benzyl-4-methoxy-2,3-dimethylpyrrolo[2,3-b]pyridine-5-carboxylate
SYSTEMATIC NAME: methyl 4-methoxy-2,3-dimethyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-5-carboxylate
MOLECULAR FORMULA: C19H20N2O3
MOLECULAR WEIGHT: 324.3737
SMILES: CC1=C(N(C2=NC=C(C(=C12)OC)C(=O)OC)CC3=CC=CC=C3)C
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Product OPENEYE NAME: ethyl 1-benzyl-4-ethoxy-2,3-dimethyl-pyrrolo[2,3-b]pyridine-5-carboxylate
CAS Name: 4-ethoxy-2,3-dimethyl-1-(phenylmethyl)-5-pyrrolo[2,3-b]pyridinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-benzyl-4-ethoxy-2,3-dimethylpyrrolo[2,3-b]pyridine-5-carboxylate
SYSTEMATIC NAME: ethyl 4-ethoxy-2,3-dimethyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-5-carboxylate
MOLECULAR FORMULA: C21H24N2O3
MOLECULAR WEIGHT: 352.42686
SMILES: CCOC1=C2C(=C(N(C2=NC=C1C(=O)OCC)CC3=CC=CC=C3)C)C
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Product OPENEYE NAME: dimethyl 2-[[(1-benzyl-3-tert-butoxycarbonyl-4,5-dimethyl-pyrrol-2-yl)amino]methylene]propanedioate
CAS Name: 2-[[[4,5-dimethyl-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-(phenylmethyl)-2-pyrrolyl]amino]methylidene]propanedioic acid dimethyl ester
IUPAC NAME: dimethyl 2-[[[1-benzyl-4,5-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]amino]methylidene]propanedioate
SYSTEMATIC NAME: dimethyl 2-[[[4,5-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-1-(phenylmethyl)pyrrol-2-yl]amino]methylidene]propanedioate
MOLECULAR FORMULA: C24H30N2O6
MOLECULAR WEIGHT: 442.5048
SMILES: CC1=C(N(C(=C1C(=O)OC(C)(C)C)NC=C(C(=O)OC)C(=O)OC)CC2=CC=CC=C2)C
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Product OPENEYE NAME: 1-benzyl-2-[(3-methoxy-2-methoxycarbonyl-3-oxo-prop-1-enyl)amino]-4,5-dimethyl-pyrrole-3-carboxylic acid
CAS Name: 2-[(3-methoxy-2-methoxycarbonyl-3-oxoprop-1-enyl)amino]-4,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid
IUPAC NAME: 1-benzyl-2-[(3-methoxy-2-methoxycarbonyl-3-oxoprop-1-enyl)amino]-4,5-dimethylpyrrole-3-carboxylic acid
SYSTEMATIC NAME: 2-[(3-methoxy-2-methoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-4,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylic acid
MOLECULAR FORMULA: C20H22N2O6
MOLECULAR WEIGHT: 386.39848
SMILES: CC1=C(N(C(=C1C(=O)O)NC=C(C(=O)OC)C(=O)OC)CC2=CC=CC=C2)C
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Product OPENEYE NAME: 1-benzyl-2-[(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)amino]-4,5-dimethyl-pyrrole-3-carboxylic acid
CAS Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-4,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid
IUPAC NAME: 1-benzyl-2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-4,5-dimethylpyrrole-3-carboxylic acid
SYSTEMATIC NAME: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-4,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylic acid
MOLECULAR FORMULA: C22H26N2O6
MOLECULAR WEIGHT: 414.45164
SMILES: CCOC(=O)C(=CNC1=C(C(=C(N1CC2=CC=CC=C2)C)C)C(=O)O)C(=O)OCC
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Product OPENEYE NAME: dimethyl 2-[[(1-benzyl-4,5-dimethyl-pyrrol-2-yl)amino]methylene]propanedioate
CAS Name: 2-[[[4,5-dimethyl-1-(phenylmethyl)-2-pyrrolyl]amino]methylidene]propanedioic acid dimethyl ester
IUPAC NAME: dimethyl 2-[[(1-benzyl-4,5-dimethylpyrrol-2-yl)amino]methylidene]propanedioate
SYSTEMATIC NAME: dimethyl 2-[[[4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]amino]methylidene]propanedioate
MOLECULAR FORMULA: C19H22N2O4
MOLECULAR WEIGHT: 342.38898
SMILES: CC1=C(N(C(=C1)NC=C(C(=O)OC)C(=O)OC)CC2=CC=CC=C2)C
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