Sunday, July 31, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-(diethylamino)ethyl 4-amino-2-chloro-benzoate
CAS Name: 4-amino-2-chlorobenzoic acid 2-(diethylamino)ethyl ester
IUPAC NAME: 2-(diethylamino)ethyl 4-amino-2-chlorobenzoate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-azanyl-2-chloranyl-benzoate
MOLECULAR FORMULA: C13H19ClN2O2
MOLECULAR WEIGHT: 270.75516
SMILES: CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl
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Product OPENEYE NAME: 2-[(2-iodobenzoyl)amino]acetic acid
CAS Name: 2-[[(2-iodophenyl)-oxomethyl]amino]acetic acid
IUPAC NAME: 2-[(2-iodobenzoyl)amino]acetic acid
SYSTEMATIC NAME: 2-[(2-iodanylphenyl)carbonylamino]ethanoic acid
MOLECULAR FORMULA: C9H8INO3
MOLECULAR WEIGHT: 305.06919
SMILES: C1=CC=C(C(=C1)C(=O)NCC(=O)O)I
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Product OPENEYE NAME: 2-phenylethyl 2-aminobenzoate
CAS Name: 2-aminobenzoic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl 2-aminobenzoate
SYSTEMATIC NAME: 2-phenylethyl 2-azanylbenzoate
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2N
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Product OPENEYE NAME: 2-isopropyl-3-methoxy-furo[3,2-g]chromen-7-one
CAS Name: 3-methoxy-2-propan-2-yl-7-furo[3,2-g][1]benzopyranone
IUPAC NAME: 3-methoxy-2-propan-2-ylfuro[3,2-g]chromen-7-one
SYSTEMATIC NAME: 3-methoxy-2-propan-2-yl-furo[3,2-g]chromen-7-one
MOLECULAR FORMULA: C15H14O4
MOLECULAR WEIGHT: 258.26926
SMILES: CC(C)C1=C(C2=C(O1)C=C3C(=C2)C=CC(=O)O3)OC
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Product OPENEYE NAME: 4-(1H-indol-3-yl)butanoic acid
CAS Name: 4-(1H-indol-3-yl)butanoic acid
IUPAC NAME: 4-(1H-indol-3-yl)butanoic acid
SYSTEMATIC NAME: 4-(1H-indol-3-yl)butanoic acid
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O
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Product OPENEYE NAME: 3,4,4-trihydroxy-2-oxo-but-3-enoic acid
CAS Name: 3,4,4-trihydroxy-2-oxo-3-butenoic acid
IUPAC NAME: 3,4,4-trihydroxy-2-oxobut-3-enoic acid
SYSTEMATIC NAME: 3,4,4-tris(oxidanyl)-2-oxidanylidene-but-3-enoic acid
MOLECULAR FORMULA: C4H4O6
MOLECULAR WEIGHT: 148.07096
SMILES: C(=C(O)O)(C(=O)C(=O)O)O
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Product OPENEYE NAME: methyl 3,4-dihydroxy-4-methoxy-2-oxo-but-3-enoate
CAS Name: 3,4-dihydroxy-4-methoxy-2-oxo-3-butenoic acid methyl ester
IUPAC NAME: methyl 3,4-dihydroxy-4-methoxy-2-oxobut-3-enoate
SYSTEMATIC NAME: methyl 4-methoxy-3,4-bis(oxidanyl)-2-oxidanylidene-but-3-enoate
MOLECULAR FORMULA: C6H8O6
MOLECULAR WEIGHT: 176.12412
SMILES: COC(=C(C(=O)C(=O)OC)O)O
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Product OPENEYE NAME: 2,3,4,5,6-pentachlorobenzenethiol
CAS Name: 2,3,4,5,6-pentachlorobenzenethiol
IUPAC NAME: 2,3,4,5,6-pentachlorobenzenethiol
SYSTEMATIC NAME: 2,3,4,5,6-pentakis(chloranyl)benzenethiol
MOLECULAR FORMULA: C6HCl5S
MOLECULAR WEIGHT: 282.40214
SMILES: C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)S
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Product OPENEYE NAME: 2,4-dichloro-3,5-dimethyl-phenol
CAS Name: 2,4-dichloro-3,5-dimethylphenol
IUPAC NAME: 2,4-dichloro-3,5-dimethylphenol
SYSTEMATIC NAME: 2,4-bis(chloranyl)-3,5-dimethyl-phenol
MOLECULAR FORMULA: C8H8Cl2O
MOLECULAR WEIGHT: 191.05452
SMILES: CC1=CC(=C(C(=C1Cl)C)Cl)O
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Product OPENEYE NAME: (2-hydroxy-3-methyl-6-nitro-phenyl)mercury
CAS Name: (2-hydroxy-3-methyl-6-nitrophenyl)mercury
IUPAC NAME: (2-hydroxy-3-methyl-6-nitrophenyl)mercury
SYSTEMATIC NAME: (3-methyl-6-nitro-2-oxidanyl-phenyl)mercury
MOLECULAR FORMULA: C7H6HgNO3
MOLECULAR WEIGHT: 352.71744
SMILES: CC1=C(C(=C(C=C1)[N+](=O)[O-])[Hg])O
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Product OPENEYE NAME: 2-methylbenzenesulfonyl chloride
CAS Name: 2-methylbenzenesulfonyl chloride
IUPAC NAME: 2-methylbenzenesulfonyl chloride
SYSTEMATIC NAME: 2-methylbenzenesulfonyl chloride
MOLECULAR FORMULA: C7H7ClO2S
MOLECULAR WEIGHT: 190.64728
SMILES: CC1=CC=CC=C1S(=O)(=O)Cl
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