Monday, August 29, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile
CAS Name: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile
IUPAC NAME: 1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile
SYSTEMATIC NAME: 1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepine-7-carbonitrile
MOLECULAR FORMULA: C17H13N3O
MOLECULAR WEIGHT: 275.30462
SMILES: CN1C(=O)CN=C(C2=C1C=CC(=C2)C#N)C3=CC=CC=C3
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Product OPENEYE NAME: 4-[4-(4-aminophenoxy)phenoxy]aniline
CAS Name: 4-[4-(4-aminophenoxy)phenoxy]aniline
IUPAC NAME: 4-[4-(4-aminophenoxy)phenoxy]aniline
SYSTEMATIC NAME: 4-[4-(4-azanylphenoxy)phenoxy]aniline
MOLECULAR FORMULA: C18H16N2O2
MOLECULAR WEIGHT: 292.33184
SMILES: C1=CC(=CC=C1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)N
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Product OPENEYE NAME: 5,6,7,8-tetrachloroquinoxaline
CAS Name: 5,6,7,8-tetrachloroquinoxaline
IUPAC NAME: 5,6,7,8-tetrachloroquinoxaline
SYSTEMATIC NAME: 5,6,7,8-tetrakis(chloranyl)quinoxaline
MOLECULAR FORMULA: C8H2Cl4N2
MOLECULAR WEIGHT: 267.92688
SMILES: C1=CN=C2C(=C(C(=C(C2=N1)Cl)Cl)Cl)Cl
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Product OPENEYE NAME: 1,2-dichlorocyclobutane-1,2-dicarbonitrile
CAS Name: 1,2-dichlorocyclobutane-1,2-dicarbonitrile
IUPAC NAME: 1,2-dichlorocyclobutane-1,2-dicarbonitrile
SYSTEMATIC NAME: 1,2-bis(chloranyl)cyclobutane-1,2-dicarbonitrile
MOLECULAR FORMULA: C6H4Cl2N2
MOLECULAR WEIGHT: 175.01536
SMILES: C1CC(C1(C#N)Cl)(C#N)Cl
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Product OPENEYE NAME: dichloro-phenyl-thioxo-$l^{5}-phosphane
CAS Name: dichloro-phenyl-sulfanylidenephosphorane
IUPAC NAME: dichloro-phenyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: bis(chloranyl)-phenyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C6H5Cl2PS
MOLECULAR WEIGHT: 211.048661
SMILES: C1=CC=C(C=C1)P(=S)(Cl)Cl
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Product OPENEYE NAME: but-2-enedioic acid; 2-[(4-chlorophenyl)-(2-pyridyl)methoxy]-N,N-dimethyl-ethanamine
CAS Name: but-2-enedioic acid; 2-[(4-chlorophenyl)-(2-pyridinyl)methoxy]-N,N-dimethylethanamine
IUPAC NAME: but-2-enedioic acid; 2-[(4-chlorophenyl)-pyridin-2-ylmethoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: but-2-enedioic acid; 2-[(4-chlorophenyl)-pyridin-2-yl-methoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C20H23ClN2O5
MOLECULAR WEIGHT: 406.86002
SMILES: CN(C)CCOC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=CC(=O)O)C(=O)O
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Product OPENEYE NAME: dimethyl-bis(3-methylsulfonyloxypropyl)ammonium; 2,4,6-trinitrobenzenesulfonate
CAS Name: dimethyl-bis(3-methylsulfonyloxypropyl)ammonium; 2,4,6-trinitrobenzenesulfonate
IUPAC NAME: dimethyl-bis(3-methylsulfonyloxypropyl)azanium; 2,4,6-trinitrobenzenesulfonate
SYSTEMATIC NAME: dimethyl-bis(3-methylsulfonyloxypropyl)azanium; 2,4,6-trinitrobenzenesulfonate
MOLECULAR FORMULA: C16H26N4O15S3
MOLECULAR WEIGHT: 610.59044
SMILES: C[N+](C)(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: dimethyl-bis(3-methylsulfonyloxypropyl)ammonium
CAS Name: dimethyl-bis(3-methylsulfonyloxypropyl)ammonium
IUPAC NAME: dimethyl-bis(3-methylsulfonyloxypropyl)azanium
SYSTEMATIC NAME: dimethyl-bis(3-methylsulfonyloxypropyl)azanium
MOLECULAR FORMULA: C10H24NO6S2+
MOLECULAR WEIGHT: 318.43066
SMILES: C[N+](C)(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C
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Product OPENEYE NAME: 2-amino-N-[5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-(4-methoxyphenyl)propanamide hydrochloride
CAS Name: 2-amino-N-[5-[6-(dimethylamino)-9-purinyl]-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]-3-(4-methoxyphenyl)propanamide hydrochloride
IUPAC NAME: 2-amino-N-[5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-(4-methoxyphenyl)propanamide hydrochloride
SYSTEMATIC NAME: 2-azanyl-N-[5-[6-(dimethylamino)purin-9-yl]-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3-(4-methoxyphenyl)propanamide hydrochloride
MOLECULAR FORMULA: C22H30ClN7O5
MOLECULAR WEIGHT: 507.9705
SMILES: CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)NC(=O)C(CC4=CC=C(C=C4)OC)N)O.Cl
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Product OPENEYE NAME: [[1-methyl-3-(4-nitrophenyl)propylidene]amino]urea
CAS Name: [4-(4-nitrophenyl)butan-2-ylideneamino]urea
IUPAC NAME: [4-(4-nitrophenyl)butan-2-ylideneamino]urea
SYSTEMATIC NAME: 1-[4-(4-nitrophenyl)butan-2-ylideneamino]urea
MOLECULAR FORMULA: C11H14N4O3
MOLECULAR WEIGHT: 250.25386
SMILES: CC(=NNC(=O)N)CCC1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 1-bromoheptadecane
CAS Name: 1-bromoheptadecane
IUPAC NAME: 1-bromoheptadecane
SYSTEMATIC NAME: 1-bromanylheptadecane
MOLECULAR FORMULA: C17H35Br
MOLECULAR WEIGHT: 319.3638
SMILES: CCCCCCCCCCCCCCCCCBr
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Product OPENEYE NAME: 3-allylpentane-2,4-dione
CAS Name: 3-prop-2-enylpentane-2,4-dione
IUPAC NAME: 3-prop-2-enylpentane-2,4-dione
SYSTEMATIC NAME: 3-prop-2-enylpentane-2,4-dione
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: CC(=O)C(CC=C)C(=O)C
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