Thursday, July 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: propyl 4-aminobenzoate
CAS Name: 4-aminobenzoic acid propyl ester
IUPAC NAME: propyl 4-aminobenzoate
SYSTEMATIC NAME: propyl 4-azanylbenzoate
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CCCOC(=O)C1=CC=C(C=C1)N
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Product OPENEYE NAME: propyl 4-hydroxybenzoate
CAS Name: 4-hydroxybenzoic acid propyl ester
IUPAC NAME: propyl 4-hydroxybenzoate
SYSTEMATIC NAME: propyl 4-oxidanylbenzoate
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: CCCOC(=O)C1=CC=C(C=C1)O
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Product OPENEYE NAME: isobutyl 4-aminobenzoate
CAS Name: 4-aminobenzoic acid 2-methylpropyl ester
IUPAC NAME: 2-methylpropyl 4-aminobenzoate
SYSTEMATIC NAME: 2-methylpropyl 4-azanylbenzoate
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CC(C)COC(=O)C1=CC=C(C=C1)N
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Product OPENEYE NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 4-aminobenzoate
CAS Name: 4-aminobenzoic acid [3-(diethylamino)-2,2-dimethylpropyl] ester
IUPAC NAME: [3-(diethylamino)-2,2-dimethylpropyl] 4-aminobenzoate
SYSTEMATIC NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 4-azanylbenzoate
MOLECULAR FORMULA: C16H26N2O2
MOLECULAR WEIGHT: 278.38984
SMILES: CCN(CC)CC(C)(C)COC(=O)C1=CC=C(C=C1)N
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Product OPENEYE NAME: (4-chlorobenzoyl) 4-chlorobenzenecarboperoxoate
CAS Name: 4-chlorobenzenecarboperoxoic acid [(4-chlorophenyl)-oxomethyl] ester
IUPAC NAME: (4-chlorobenzoyl) 4-chlorobenzenecarboperoxoate
SYSTEMATIC NAME: (4-chlorophenyl)carbonyl 4-chloranylbenzenecarboperoxoate
MOLECULAR FORMULA: C14H8Cl2O4
MOLECULAR WEIGHT: 311.11692
SMILES: C1=CC(=CC=C1C(=O)OOC(=O)C2=CC=C(C=C2)Cl)Cl
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Product OPENEYE NAME: benzyl 4-hydroxybenzoate
CAS Name: 4-hydroxybenzoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-hydroxybenzoate
SYSTEMATIC NAME: (phenylmethyl) 4-oxidanylbenzoate
MOLECULAR FORMULA: C14H12O3
MOLECULAR WEIGHT: 228.24328
SMILES: C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)O
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Product OPENEYE NAME: 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
CAS Name: 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
IUPAC NAME: 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C10H12N4O2S2
MOLECULAR WEIGHT: 284.35788
SMILES: CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N
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Product OPENEYE NAME: propyl 4-nitrobenzoate
CAS Name: 4-nitrobenzoic acid propyl ester
IUPAC NAME: propyl 4-nitrobenzoate
SYSTEMATIC NAME: propyl 4-nitrobenzoate
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: CCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(diethylamino)ethyl 4-ethoxybenzoate
CAS Name: 4-ethoxybenzoic acid 2-(diethylamino)ethyl ester
IUPAC NAME: 2-(diethylamino)ethyl 4-ethoxybenzoate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-ethoxybenzoate
MOLECULAR FORMULA: C15H23NO3
MOLECULAR WEIGHT: 265.34802
SMILES: CCN(CC)CCOC(=O)C1=CC=C(C=C1)OCC
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Product OPENEYE NAME: butyl 4-hydroxybenzoate
CAS Name: 4-hydroxybenzoic acid butyl ester
IUPAC NAME: butyl 4-hydroxybenzoate
SYSTEMATIC NAME: butyl 4-oxidanylbenzoate
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CCCCOC(=O)C1=CC=C(C=C1)O
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Product OPENEYE NAME: 2-[2-[2-(2-ethylhexanoyloxy)ethoxy]ethoxy]ethyl 2-ethylhexanoate
CAS Name: 2-ethylhexanoic acid 2-[2-[2-(2-ethyl-1-oxohexoxy)ethoxy]ethoxy]ethyl ester
IUPAC NAME: 2-[2-[2-(2-ethylhexanoyloxy)ethoxy]ethoxy]ethyl 2-ethylhexanoate
SYSTEMATIC NAME: 2-[2-[2-(2-ethylhexanoyloxy)ethoxy]ethoxy]ethyl 2-ethylhexanoate
MOLECULAR FORMULA: C22H42O6
MOLECULAR WEIGHT: 402.56528
SMILES: CCCCC(CC)C(=O)OCCOCCOCCOC(=O)C(CC)CCCC
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