Saturday, August 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-pyrrolidin-1-ylethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(1-pyrrolidinyl)ethyl ester
IUPAC NAME: 2-pyrrolidin-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-pyrrolidin-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C24H31NO3
MOLECULAR WEIGHT: 381.50784
SMILES: C1CCN(C1)CCOC(=O)C(CC2CCCO2)CC3=CC=CC4=CC=CC=C43
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Product OPENEYE NAME: 2-hydroxy-2-oxo-acetate; 2-morpholin-4-ium-4-ylethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-hydroxy-2-oxoacetate; 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(4-morpholin-4-iumyl)ethyl ester
IUPAC NAME: 2-hydroxy-2-oxoacetate; 2-morpholin-4-ium-4-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-morpholin-4-ium-4-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate; 2-oxidanyl-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C26H33NO8
MOLECULAR WEIGHT: 487.54212
SMILES: C1CC(OC1)CC(CC2=CC=CC3=CC=CC=C32)C(=O)OCC[NH+]4CCOCC4.C(=O)(C(=O)[O-])O
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Product OPENEYE NAME: 2-morpholinoethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C24H31NO4
MOLECULAR WEIGHT: 397.50724
SMILES: C1CC(OC1)CC(CC2=CC=CC3=CC=CC=C32)C(=O)OCCN4CCOCC4
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Product OPENEYE NAME: dimethyl-[2-[2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoyl]oxyethyl]ammonium; 2-hydroxy-2-oxo-acetate
CAS Name: dimethyl-[2-[2-(1-naphthalenylmethyl)-1-oxo-3-(2-oxolanyl)propoxy]ethyl]ammonium; 2-hydroxy-2-oxoacetate
IUPAC NAME: dimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-hydroxy-2-oxoacetate
SYSTEMATIC NAME: dimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C24H31NO7
MOLECULAR WEIGHT: 445.50544
SMILES: C[NH+](C)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O
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Product OPENEYE NAME: 2-(dimethylamino)ethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(dimethylamino)ethyl ester
IUPAC NAME: 2-(dimethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C22H29NO3
MOLECULAR WEIGHT: 355.47056
SMILES: CN(C)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: 2-hydroxy-2-oxo-acetate; 2-piperidin-1-ium-1-ylethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-hydroxy-2-oxoacetate; 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(1-piperidin-1-iumyl)ethyl ester
IUPAC NAME: 2-hydroxy-2-oxoacetate; 2-piperidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-oxidanyl-2-oxidanylidene-ethanoate; 2-piperidin-1-ium-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C27H35NO7
MOLECULAR WEIGHT: 485.5693
SMILES: C1CC[NH+](CC1)CCOC(=O)C(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O
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Product OPENEYE NAME: 2-(1-piperidyl)ethyl 2-(1-naphthylmethyl)-3-tetrahydrofuran-2-yl-propanoate
CAS Name: 2-(1-naphthalenylmethyl)-3-(2-oxolanyl)propanoic acid 2-(1-piperidinyl)ethyl ester
IUPAC NAME: 2-piperidin-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
SYSTEMATIC NAME: 2-piperidin-1-ylethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
MOLECULAR FORMULA: C25H33NO3
MOLECULAR WEIGHT: 395.53442
SMILES: C1CCN(CC1)CCOC(=O)C(CC2CCCO2)CC3=CC=CC4=CC=CC=C43
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Product OPENEYE NAME: butyl-[2-(2-ethoxy-2,2-diphenyl-acetyl)oxyethyl]-ethyl-ammonium chloride
CAS Name: butyl-[2-(2-ethoxy-1-oxo-2,2-diphenylethoxy)ethyl]-ethylammonium chloride
IUPAC NAME: butyl-[2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl]-ethylazanium chloride
SYSTEMATIC NAME: butyl-[2-(2-ethoxy-2,2-diphenyl-ethanoyl)oxyethyl]-ethyl-azanium chloride
MOLECULAR FORMULA: C24H34ClNO3
MOLECULAR WEIGHT: 419.98466
SMILES: CCCC[NH+](CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC.[Cl-]
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Product OPENEYE NAME: 2-[butyl(ethyl)amino]ethyl 2-ethoxy-2,2-diphenyl-acetate
CAS Name: 2-ethoxy-2,2-diphenylacetic acid 2-[butyl(ethyl)amino]ethyl ester
IUPAC NAME: 2-[butyl(ethyl)amino]ethyl 2-ethoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[butyl(ethyl)amino]ethyl 2-ethoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C24H33NO3
MOLECULAR WEIGHT: 383.52372
SMILES: CCCCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC
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Product OPENEYE NAME: cyclobutane-1,2-dicarbonitrile
CAS Name: cyclobutane-1,2-dicarbonitrile
IUPAC NAME: cyclobutane-1,2-dicarbonitrile
SYSTEMATIC NAME: cyclobutane-1,2-dicarbonitrile
MOLECULAR FORMULA: C6H6N2
MOLECULAR WEIGHT: 106.12524
SMILES: C1CC(C1C#N)C#N
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Product OPENEYE NAME: (1-methylpyrrolidin-1-ium-2-yl)methyl 2-benzyloxy-2,2-diphenyl-acetate chloride
CAS Name: 2,2-diphenyl-2-phenylmethoxyacetic acid (1-methyl-2-pyrrolidin-1-iumyl)methyl ester chloride
IUPAC NAME: (1-methylpyrrolidin-1-ium-2-yl)methyl 2,2-diphenyl-2-phenylmethoxyacetate chloride
SYSTEMATIC NAME: (1-methylpyrrolidin-1-ium-2-yl)methyl 2,2-diphenyl-2-phenylmethoxy-ethanoate chloride
MOLECULAR FORMULA: C27H30ClNO3
MOLECULAR WEIGHT: 451.985
SMILES: C[NH+]1CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: (1-methylpyrrolidin-2-yl)methyl 2-benzyloxy-2,2-diphenyl-acetate
CAS Name: 2,2-diphenyl-2-phenylmethoxyacetic acid (1-methyl-2-pyrrolidinyl)methyl ester
IUPAC NAME: (1-methylpyrrolidin-2-yl)methyl 2,2-diphenyl-2-phenylmethoxyacetate
SYSTEMATIC NAME: (1-methylpyrrolidin-2-yl)methyl 2,2-diphenyl-2-phenylmethoxy-ethanoate
MOLECULAR FORMULA: C27H29NO3
MOLECULAR WEIGHT: 415.52406
SMILES: CN1CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4=CC=CC=C4
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Product OPENEYE NAME: cyclopenten-1-ol
CAS Name: 1-cyclopentenol
IUPAC NAME: cyclopenten-1-ol
SYSTEMATIC NAME: cyclopenten-1-ol
MOLECULAR FORMULA: C5H8O
MOLECULAR WEIGHT: 84.11642
SMILES: C1CC=C(C1)O
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Product OPENEYE NAME: 2-(diethylamino)-N-(o-tolyl)acetamide
CAS Name: 2-(diethylamino)-N-(2-methylphenyl)acetamide
IUPAC NAME: 2-(diethylamino)-N-(2-methylphenyl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(2-methylphenyl)ethanamide
MOLECULAR FORMULA: C13H20N2O
MOLECULAR WEIGHT: 220.3107
SMILES: CCN(CC)CC(=O)NC1=CC=CC=C1C
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-diethyl-ammonium chloride
CAS Name: (2-anilino-2-oxoethyl)-diethylammonium chloride
IUPAC NAME: (2-anilino-2-oxoethyl)-diethylazanium chloride
SYSTEMATIC NAME: diethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium chloride
MOLECULAR FORMULA: C12H19ClN2O
MOLECULAR WEIGHT: 242.74506
SMILES: CC[NH+](CC)CC(=O)NC1=CC=CC=C1.[Cl-]
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Product OPENEYE NAME: 2-(diethylamino)-N-phenyl-acetamide
CAS Name: 2-(diethylamino)-N-phenylacetamide
IUPAC NAME: 2-(diethylamino)-N-phenylacetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-phenyl-ethanamide
MOLECULAR FORMULA: C12H18N2O
MOLECULAR WEIGHT: 206.28412
SMILES: CCN(CC)CC(=O)NC1=CC=CC=C1
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Product OPENEYE NAME: 2-(2,2-diphenylacetyl)oxypropyl-diethyl-ammonium chloride
CAS Name: diethyl-[2-(1-oxo-2,2-diphenylethoxy)propyl]ammonium chloride
IUPAC NAME: 2-(2,2-diphenylacetyl)oxypropyl-diethylazanium chloride
SYSTEMATIC NAME: 2-(2,2-diphenylethanoyloxy)propyl-diethyl-azanium chloride
MOLECULAR FORMULA: C21H28ClNO2
MOLECULAR WEIGHT: 361.90552
SMILES: CC[NH+](CC)CC(C)OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]
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Product OPENEYE NAME: [2-(diethylamino)-1-methyl-ethyl] 2,2-diphenylacetate
CAS Name: 2,2-diphenylacetic acid 1-(diethylamino)propan-2-yl ester
IUPAC NAME: 1-(diethylamino)propan-2-yl 2,2-diphenylacetate
SYSTEMATIC NAME: 1-(diethylamino)propan-2-yl 2,2-diphenylethanoate
MOLECULAR FORMULA: C21H27NO2
MOLECULAR WEIGHT: 325.44458
SMILES: CCN(CC)CC(C)OC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: tetrasodium 3-[4-[[4-[(4,8-disulfonato-2-naphthyl)azo]-3-methyl-phenyl]carbamoylamino]-2-methyl-phenyl]azonaphthalene-1,5-disulfonate
CAS Name: tetrasodium 3-[4-[[[4-[(4,8-disulfonato-2-naphthalenyl)azo]-3-methylanilino]-oxomethyl]amino]-2-methylphenyl]azonaphthalene-1,5-disulfonate
IUPAC NAME: tetrasodium 3-[[4-[[4-[(4,8-disulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]carbamoylamino]-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonate
SYSTEMATIC NAME: tetrasodium 3-[[4-[[4-[(4,8-disulfonatonaphthalen-2-yl)diazenyl]-3-methyl-phenyl]carbamoylamino]-2-methyl-phenyl]diazenyl]naphthalene-1,5-disulfonate
MOLECULAR FORMULA: C35H24N6Na4O13S4
MOLECULAR WEIGHT: 956.81654
SMILES: CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
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Product OPENEYE NAME: 3-[4-[[4-[(4,8-disulfo-2-naphthyl)azo]-3-methyl-phenyl]carbamoylamino]-2-methyl-phenyl]azonaphthalene-1,5-disulfonic acid
CAS Name: 3-[4-[[[4-[(4,8-disulfo-2-naphthalenyl)azo]-3-methylanilino]-oxomethyl]amino]-2-methylphenyl]azonaphthalene-1,5-disulfonic acid
IUPAC NAME: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-methylphenyl]carbamoylamino]-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonic acid
SYSTEMATIC NAME: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-methyl-phenyl]carbamoylamino]-2-methyl-phenyl]diazenyl]naphthalene-1,5-disulfonic acid
MOLECULAR FORMULA: C35H28N6O13S4
MOLECULAR WEIGHT: 868.88922
SMILES: CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O
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