Saturday, June 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 1-(3-benzyloxy-4-methoxy-benzoyl)pyrrolidin-2-one
CAS Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)-oxomethyl]-2-pyrrolidinone
IUPAC NAME: 1-(4-methoxy-3-phenylmethoxybenzoyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-(4-methoxy-3-phenylmethoxy-phenyl)carbonylpyrrolidin-2-one
MOLECULAR FORMULA: C19H19NO4
MOLECULAR WEIGHT: 325.35846
SMILES: COC1=C(C=C(C=C1)C(=O)N2CCCC2=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: [2-methoxy-5-(2-oxopyrrolidine-1-carbonyl)phenyl] benzoate
CAS Name: benzoic acid [2-methoxy-5-[oxo-(2-oxo-1-pyrrolidinyl)methyl]phenyl] ester
IUPAC NAME: [2-methoxy-5-(2-oxopyrrolidine-1-carbonyl)phenyl] benzoate
SYSTEMATIC NAME: [2-methoxy-5-(2-oxidanylidenepyrrolidin-1-yl)carbonyl-phenyl] benzoate
MOLECULAR FORMULA: C19H17NO5
MOLECULAR WEIGHT: 339.34198
SMILES: COC1=C(C=C(C=C1)C(=O)N2CCCC2=O)OC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 4-[(3-benzyloxy-4-methoxy-benzoyl)amino]-3-hydroxy-butanoic acid
CAS Name: 3-hydroxy-4-[[(4-methoxy-3-phenylmethoxyphenyl)-oxomethyl]amino]butanoic acid
IUPAC NAME: 3-hydroxy-4-[(4-methoxy-3-phenylmethoxybenzoyl)amino]butanoic acid
SYSTEMATIC NAME: 4-[(4-methoxy-3-phenylmethoxy-phenyl)carbonylamino]-3-oxidanyl-butanoic acid
MOLECULAR FORMULA: C19H21NO6
MOLECULAR WEIGHT: 359.37314
SMILES: COC1=C(C=C(C=C1)C(=O)NCC(CC(=O)O)O)OCC2=CC=CC=C2
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Product OPENEYE NAME: 4-[(3-benzyloxy-4-methoxy-benzoyl)amino]butanoic acid
CAS Name: 4-[[(4-methoxy-3-phenylmethoxyphenyl)-oxomethyl]amino]butanoic acid
IUPAC NAME: 4-[(4-methoxy-3-phenylmethoxybenzoyl)amino]butanoic acid
SYSTEMATIC NAME: 4-[(4-methoxy-3-phenylmethoxy-phenyl)carbonylamino]butanoic acid
MOLECULAR FORMULA: C19H21NO5
MOLECULAR WEIGHT: 343.37374
SMILES: COC1=C(C=C(C=C1)C(=O)NCCCC(=O)O)OCC2=CC=CC=C2
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Product OPENEYE NAME: 1-(3-benzyloxy-4-methoxy-benzoyl)-2H-pyrrol-5-one
CAS Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)-oxomethyl]-2H-pyrrol-5-one
IUPAC NAME: 1-(4-methoxy-3-phenylmethoxybenzoyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 1-(4-methoxy-3-phenylmethoxy-phenyl)carbonyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C19H17NO4
MOLECULAR WEIGHT: 323.34258
SMILES: COC1=C(C=C(C=C1)C(=O)N2CC=CC2=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: 2-[3-hydroxy-3-(4-methoxyphenyl)propyl]phenol
CAS Name: 2-[3-hydroxy-3-(4-methoxyphenyl)propyl]phenol
IUPAC NAME: 2-[3-hydroxy-3-(4-methoxyphenyl)propyl]phenol
SYSTEMATIC NAME: 2-[3-(4-methoxyphenyl)-3-oxidanyl-propyl]phenol
MOLECULAR FORMULA: C16H18O3
MOLECULAR WEIGHT: 258.31232
SMILES: COC1=CC=C(C=C1)C(CCC2=CC=CC=C2O)O
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Product OPENEYE NAME: 2-(3-chlorophenyl)chromane
CAS Name: 2-(3-chlorophenyl)-3,4-dihydro-2H-1-benzopyran
IUPAC NAME: 2-(3-chlorophenyl)-3,4-dihydro-2H-chromene
SYSTEMATIC NAME: 2-(3-chlorophenyl)-3,4-dihydro-2H-chromene
MOLECULAR FORMULA: C15H13ClO
MOLECULAR WEIGHT: 244.71612
SMILES: C1CC2=CC=CC=C2OC1C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: 2-(m-tolyl)chromane
CAS Name: 2-(3-methylphenyl)-3,4-dihydro-2H-1-benzopyran
IUPAC NAME: 2-(3-methylphenyl)-3,4-dihydro-2H-chromene
SYSTEMATIC NAME: 2-(3-methylphenyl)-3,4-dihydro-2H-chromene
MOLECULAR FORMULA: C16H16O
MOLECULAR WEIGHT: 224.29764
SMILES: CC1=CC=CC(=C1)C2CCC3=CC=CC=C3O2
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Product OPENEYE NAME: N-[4-[(E)-3-(2-hydroxyphenyl)-3-oxo-prop-1-enyl]phenyl]acetamide
CAS Name: N-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]acetamide
IUPAC NAME: N-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[(E)-3-(2-hydroxyphenyl)-3-oxidanylidene-prop-1-enyl]phenyl]ethanamide
MOLECULAR FORMULA: C17H15NO3
MOLECULAR WEIGHT: 281.3059
SMILES: CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2O
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Product OPENEYE NAME: 7-chloro-2-(4-chlorophenyl)chromane
CAS Name: 7-chloro-2-(4-chlorophenyl)-3,4-dihydro-2H-1-benzopyran
IUPAC NAME: 7-chloro-2-(4-chlorophenyl)-3,4-dihydro-2H-chromene
SYSTEMATIC NAME: 7-chloranyl-2-(4-chlorophenyl)-3,4-dihydro-2H-chromene
MOLECULAR FORMULA: C15H12Cl2O
MOLECULAR WEIGHT: 279.16118
SMILES: C1CC2=C(C=C(C=C2)Cl)OC1C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-phenylchroman-4-one hydrochloride
CAS Name: 2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one hydrochloride
IUPAC NAME: 2-phenyl-2,3-dihydrochromen-4-one hydrochloride
SYSTEMATIC NAME: 2-phenyl-2,3-dihydrochromen-4-one hydrochloride
MOLECULAR FORMULA: C15H13ClO2
MOLECULAR WEIGHT: 260.71552
SMILES: C1C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3.Cl
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Product OPENEYE NAME: 6,8-dichloro-2-phenyl-chromane
CAS Name: 6,8-dichloro-2-phenyl-3,4-dihydro-2H-1-benzopyran
IUPAC NAME: 6,8-dichloro-2-phenyl-3,4-dihydro-2H-chromene
SYSTEMATIC NAME: 6,8-bis(chloranyl)-2-phenyl-3,4-dihydro-2H-chromene
MOLECULAR FORMULA: C15H12Cl2O
MOLECULAR WEIGHT: 279.16118
SMILES: C1CC2=CC(=CC(=C2OC1C3=CC=CC=C3)Cl)Cl
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