Saturday, August 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: [4-[(2-aminoacetyl)amino]phenyl]-bis(2-chloroethyl)ammonium chloride
CAS Name: [4-[(2-amino-1-oxoethyl)amino]phenyl]-bis(2-chloroethyl)ammonium chloride
IUPAC NAME: [4-[(2-aminoacetyl)amino]phenyl]-bis(2-chloroethyl)azanium chloride
SYSTEMATIC NAME: [4-(2-azanylethanoylamino)phenyl]-bis(2-chloroethyl)azanium chloride
MOLECULAR FORMULA: C12H18Cl3N3O
MOLECULAR WEIGHT: 326.64982
SMILES: C1=CC(=CC=C1NC(=O)CN)[NH+](CCCl)CCCl.[Cl-]
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Product OPENEYE NAME: 2-amino-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide
CAS Name: 2-amino-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide
IUPAC NAME: 2-amino-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide
SYSTEMATIC NAME: 2-azanyl-N-[4-[bis(2-chloroethyl)amino]phenyl]ethanamide
MOLECULAR FORMULA: C12H17Cl2N3O
MOLECULAR WEIGHT: 290.18888
SMILES: C1=CC(=CC=C1NC(=O)CN)N(CCCl)CCCl
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Product OPENEYE NAME: (9S,14S)-3,4-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS Name: (9S,14S)-3,4-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
IUPAC NAME: (9S,14S)-3,4-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (9S,14S)-13-methyl-3,4-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C18H22O3
MOLECULAR WEIGHT: 286.36548
SMILES: CC12CC[C@H]3C([C@@H]1CCC2=O)CCC4=C3C=CC(=C4O)O
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Product OPENEYE NAME: N-benzyl-N-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)aniline; methanesulfonate
CAS Name: N-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-N-(phenylmethyl)aniline; methanesulfonate
IUPAC NAME: N-benzyl-N-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)aniline; methanesulfonate
SYSTEMATIC NAME: N-(4,5-dihydro-1H-imidazol-1-ium-2-ylmethyl)-N-(phenylmethyl)aniline; methanesulfonate
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: CS(=O)(=O)[O-].C1CN=C([NH2+]1)CN(CC2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-(2-phenylethyl)ammonium bromide
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-(2-phenylethyl)ammonium bromide
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-(2-phenylethyl)azanium bromide
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-(2-phenylethyl)azanium bromide
MOLECULAR FORMULA: C18H23BrN2O
MOLECULAR WEIGHT: 363.29202
SMILES: C[N+](C)(CCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2.[Br-]
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-(2-phenylethyl)ammonium
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-(2-phenylethyl)ammonium
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-(2-phenylethyl)azanium
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-(2-phenylethyl)azanium
MOLECULAR FORMULA: C18H23N2O+
MOLECULAR WEIGHT: 283.38802
SMILES: C[N+](C)(CCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-(3-phenylpropyl)ammonium bromide
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-(3-phenylpropyl)ammonium bromide
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-(3-phenylpropyl)azanium bromide
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-(3-phenylpropyl)azanium bromide
MOLECULAR FORMULA: C19H25BrN2O
MOLECULAR WEIGHT: 377.3186
SMILES: C[N+](C)(CCCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2.[Br-]
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-(3-phenylpropyl)ammonium
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-(3-phenylpropyl)ammonium
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-(3-phenylpropyl)azanium
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-(3-phenylpropyl)azanium
MOLECULAR FORMULA: C19H25N2O+
MOLECULAR WEIGHT: 297.4146
SMILES: C[N+](C)(CCCC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-dimethyl-(3-phenylpropyl)ammonium bromide
CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-(3-phenylpropyl)ammonium bromide
IUPAC NAME: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-(3-phenylpropyl)azanium bromide
SYSTEMATIC NAME: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-(3-phenylpropyl)azanium bromide
MOLECULAR FORMULA: C21H29BrN2O
MOLECULAR WEIGHT: 405.37176
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)CCCC2=CC=CC=C2.[Br-]
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Product OPENEYE NAME: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-dimethyl-(3-phenylpropyl)ammonium
CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-(3-phenylpropyl)ammonium
IUPAC NAME: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-(3-phenylpropyl)azanium
SYSTEMATIC NAME: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-(3-phenylpropyl)azanium
MOLECULAR FORMULA: C21H29N2O+
MOLECULAR WEIGHT: 325.46776
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)CCCC2=CC=CC=C2
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-phenacyl-ammonium bromide
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-phenacylammonium bromide
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-phenacylazanium bromide
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-phenacyl-azanium bromide
MOLECULAR FORMULA: C18H21BrN2O2
MOLECULAR WEIGHT: 377.27554
SMILES: C[N+](C)(CC(=O)C1=CC=CC=C1)CC(=O)NC2=CC=CC=C2.[Br-]
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Product OPENEYE NAME: (2-anilino-2-oxo-ethyl)-dimethyl-phenacyl-ammonium
CAS Name: (2-anilino-2-oxoethyl)-dimethyl-phenacylammonium
IUPAC NAME: (2-anilino-2-oxoethyl)-dimethyl-phenacylazanium
SYSTEMATIC NAME: dimethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-phenacyl-azanium
MOLECULAR FORMULA: C18H21N2O2+
MOLECULAR WEIGHT: 297.37154
SMILES: C[N+](C)(CC(=O)C1=CC=CC=C1)CC(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-dimethyl-phenacyl-ammonium bromide
CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-phenacylammonium bromide
IUPAC NAME: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-phenacylazanium bromide
SYSTEMATIC NAME: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-phenacyl-azanium bromide
MOLECULAR FORMULA: C20H25BrN2O2
MOLECULAR WEIGHT: 405.3287
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)CC(=O)C2=CC=CC=C2.[Br-]
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Product OPENEYE NAME: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-dimethyl-phenacyl-ammonium
CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-phenacylammonium
IUPAC NAME: [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-phenacylazanium
SYSTEMATIC NAME: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-phenacyl-azanium
MOLECULAR FORMULA: C20H25N2O2+
MOLECULAR WEIGHT: 325.4247
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)CC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(bromomethyl)oxirane
CAS Name: 2-(bromomethyl)oxirane
IUPAC NAME: 2-(bromomethyl)oxirane
SYSTEMATIC NAME: 2-(bromomethyl)oxirane
MOLECULAR FORMULA: C3H5BrO
MOLECULAR WEIGHT: 136.9752
SMILES: C1C(O1)CBr
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