Tuesday, August 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: methyl N,N-dimethylcarbamodithioate
CAS Name: N,N-dimethylcarbamodithioic acid methyl ester
IUPAC NAME: methyl N,N-dimethylcarbamodithioate
SYSTEMATIC NAME: methyl N,N-dimethylcarbamodithioate
MOLECULAR FORMULA: C4H9NS2
MOLECULAR WEIGHT: 135.25096
SMILES: CN(C)C(=S)SC
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Product OPENEYE NAME: 1,3-dimethyl-7-[2-[(1-methyl-2-phenyl-ethyl)amino]ethyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-7-[2-(1-phenylpropan-2-ylamino)ethyl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-7-[2-(1-phenylpropan-2-ylamino)ethyl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-7-[2-(1-phenylpropan-2-ylamino)ethyl]purine-2,6-dione
MOLECULAR FORMULA: C18H23N5O2
MOLECULAR WEIGHT: 341.40752
SMILES: CC(CC1=CC=CC=C1)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 2-(N-acetyl-4-ethoxy-anilino)-N,N-dimethyl-acetamide
CAS Name: 2-(N-acetyl-4-ethoxyanilino)-N,N-dimethylacetamide
IUPAC NAME: 2-(N-acetyl-4-ethoxyanilino)-N,N-dimethylacetamide
SYSTEMATIC NAME: 2-[ethanoyl-(4-ethoxyphenyl)amino]-N,N-dimethyl-ethanamide
MOLECULAR FORMULA: C14H20N2O3
MOLECULAR WEIGHT: 264.3202
SMILES: CCOC1=CC=C(C=C1)N(CC(=O)N(C)C)C(=O)C
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Product OPENEYE NAME: [4-[(2,2-dichloroacetyl)-methyl-amino]phenyl] furan-2-carboxylate
CAS Name: 2-furancarboxylic acid [4-[(2,2-dichloro-1-oxoethyl)-methylamino]phenyl] ester
IUPAC NAME: [4-[(2,2-dichloroacetyl)-methylamino]phenyl] furan-2-carboxylate
SYSTEMATIC NAME: [4-[2,2-bis(chloranyl)ethanoyl-methyl-amino]phenyl] furan-2-carboxylate
MOLECULAR FORMULA: C14H11Cl2NO4
MOLECULAR WEIGHT: 328.14744
SMILES: CN(C1=CC=C(C=C1)OC(=O)C2=CC=CO2)C(=O)C(Cl)Cl
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Product OPENEYE NAME: 2-pyrrolidin-1-ium-1-ylpropyl 2,6-dimethyl-4-propoxy-benzoate chloride
CAS Name: 2,6-dimethyl-4-propoxybenzoic acid 2-(1-pyrrolidin-1-iumyl)propyl ester chloride
IUPAC NAME: 2-pyrrolidin-1-ium-1-ylpropyl 2,6-dimethyl-4-propoxybenzoate chloride
SYSTEMATIC NAME: 2-pyrrolidin-1-ium-1-ylpropyl 2,6-dimethyl-4-propoxy-benzoate chloride
MOLECULAR FORMULA: C19H30ClNO3
MOLECULAR WEIGHT: 355.8994
SMILES: CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)[NH+]2CCCC2)C.[Cl-]
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Product OPENEYE NAME: 2-pyrrolidin-1-ylpropyl 2,6-dimethyl-4-propoxy-benzoate
CAS Name: 2,6-dimethyl-4-propoxybenzoic acid 2-(1-pyrrolidinyl)propyl ester
IUPAC NAME: 2-pyrrolidin-1-ylpropyl 2,6-dimethyl-4-propoxybenzoate
SYSTEMATIC NAME: 2-pyrrolidin-1-ylpropyl 2,6-dimethyl-4-propoxy-benzoate
MOLECULAR FORMULA: C19H29NO3
MOLECULAR WEIGHT: 319.43846
SMILES: CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)N2CCCC2)C
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Product OPENEYE NAME: disodium 3-[[2-[2-(3-carboxylato-2,4,6-triiodo-anilino)-2-oxo-ethoxy]acetyl]amino]-2,4,6-triiodo-benzoate
CAS Name: disodium 3-[[2-[2-(3-carboxylato-2,4,6-triiodoanilino)-2-oxoethoxy]-1-oxoethyl]amino]-2,4,6-triiodobenzoate
IUPAC NAME: disodium 3-[[2-[2-(3-carboxylato-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoate
SYSTEMATIC NAME: disodium 3-[2-[2-[[3-carboxylato-2,4,6-tris(iodanyl)phenyl]amino]-2-oxidanylidene-ethoxy]ethanoylamino]-2,4,6-tris(iodanyl)benzoate
MOLECULAR FORMULA: C18H8I6N2Na2O7
MOLECULAR WEIGHT: 1171.67168
SMILES: C1=C(C(=C(C(=C1I)NC(=O)COCC(=O)NC2=C(C=C(C(=C2I)C(=O)[O-])I)I)I)C(=O)[O-])I.[Na+].[Na+]
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Product OPENEYE NAME: diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]ammonium chloride
CAS Name: diethyl-[2-[4-[(4-methoxyphenoxy)-oxomethyl]phenoxy]pentyl]ammonium chloride
IUPAC NAME: diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]azanium chloride
SYSTEMATIC NAME: diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]azanium chloride
MOLECULAR FORMULA: C23H32ClNO4
MOLECULAR WEIGHT: 421.95748
SMILES: CCCC(C[NH+](CC)CC)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC.[Cl-]
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Product OPENEYE NAME: (4-methoxyphenyl) 4-[1-(diethylaminomethyl)butoxy]benzoate
CAS Name: 4-[1-(diethylamino)pentan-2-yloxy]benzoic acid (4-methoxyphenyl) ester
IUPAC NAME: (4-methoxyphenyl) 4-[1-(diethylamino)pentan-2-yloxy]benzoate
SYSTEMATIC NAME: (4-methoxyphenyl) 4-[1-(diethylamino)pentan-2-yloxy]benzoate
MOLECULAR FORMULA: C23H31NO4
MOLECULAR WEIGHT: 385.49654
SMILES: CCCC(CN(CC)CC)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC
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