Friday, June 28, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 2,2-dimethylpropanoyloxymethyl 3-methyl-7-(6-nitro-1H-benzimidazol-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-methyl-7-(6-nitro-1H-benzimidazol-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester
IUPAC NAME: 2,2-dimethylpropanoyloxymethyl 3-methyl-7-(6-nitro-1H-benzimidazol-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 2,2-dimethylpropanoyloxymethyl 3-methyl-7-(6-nitro-1H-benzimidazol-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C21H22N4O7S
MOLECULAR WEIGHT: 474.48698
SMILES: CC1=C(N2C(C(C2=O)C3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-])SC1)C(=O)OCOC(=O)C(C)(C)C
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Product OPENEYE NAME: N-[1-(4-benzyloxyphenyl)-2-nitro-ethyl]hydroxylamine
CAS Name: N-[2-nitro-1-(4-phenylmethoxyphenyl)ethyl]hydroxylamine
IUPAC NAME: N-[2-nitro-1-(4-phenylmethoxyphenyl)ethyl]hydroxylamine
SYSTEMATIC NAME: N-[2-nitro-1-(4-phenylmethoxyphenyl)ethyl]hydroxylamine
MOLECULAR FORMULA: C15H16N2O4
MOLECULAR WEIGHT: 288.29854
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C(C[N+](=O)[O-])NO
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Product OPENEYE NAME: tert-butyl 7-(dibromomethyleneamino)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-(dibromomethylideneamino)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 7-(dibromomethylideneamino)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 7-[bis(bromanyl)methylideneamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C13H16Br2N2O3S
MOLECULAR WEIGHT: 440.15074
SMILES: CC1=C(N2C(C(C2=O)N=C(Br)Br)SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 4-(1,2-diaminoethyl)phenol hydrochloride
CAS Name: 4-(1,2-diaminoethyl)phenol hydrochloride
IUPAC NAME: 4-(1,2-diaminoethyl)phenol hydrochloride
SYSTEMATIC NAME: 4-[1,2-bis(azanyl)ethyl]phenol hydrochloride
MOLECULAR FORMULA: C8H13ClN2O
MOLECULAR WEIGHT: 188.65462
SMILES: C1=CC(=CC=C1C(CN)N)O.Cl
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Product OPENEYE NAME: 4-(1,2-diaminoethyl)phenol
CAS Name: 4-(1,2-diaminoethyl)phenol
IUPAC NAME: 4-(1,2-diaminoethyl)phenol
SYSTEMATIC NAME: 4-[1,2-bis(azanyl)ethyl]phenol
MOLECULAR FORMULA: C8H12N2O
MOLECULAR WEIGHT: 152.19368
SMILES: C1=CC(=CC=C1C(CN)N)O
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Product OPENEYE NAME: 7-[(5-methyl-1H-imidazol-2-yl)amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[(5-methyl-1H-imidazol-2-yl)amino]-8-oxo-3-[(2H-triazol-4-ylthio)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[(5-methyl-1H-imidazol-2-yl)amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[(5-methyl-1H-imidazol-2-yl)amino]-8-oxidanylidene-3-(2H-1,2,3-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H15N7O3S2
MOLECULAR WEIGHT: 393.444
SMILES: CC1=CN=C(N1)NC2C3N(C2=O)C(=C(CS3)CSC4=NNN=C4)C(=O)O
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Product OPENEYE NAME: 2,2-dimethylpropanoyloxymethyl 7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; 4-methylbenzenesulfonic acid
CAS Name: 7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester; 4-methylbenzenesulfonic acid
IUPAC NAME: 2,2-dimethylpropanoyloxymethyl 7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; 4-methylbenzenesulfonic acid
SYSTEMATIC NAME: 2,2-dimethylpropanoyloxymethyl 7-azanyl-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate; 4-methylbenzenesulfonic acid
MOLECULAR FORMULA: C21H28N2O8S2
MOLECULAR WEIGHT: 500.58562
SMILES: CC1=C(N2C(C(C2=O)N)SC1)C(=O)OCOC(=O)C(C)(C)C.CC1=CC=C(C=C1)S(=O)(=O)O
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Product OPENEYE NAME: 3-methyl-8-oxo-7-[(5-phenyl-4,5-dihydro-1H-imidazol-2-yl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-methyl-8-oxo-7-[(5-phenyl-4,5-dihydro-1H-imidazol-2-yl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-methyl-8-oxo-7-[(5-phenyl-4,5-dihydro-1H-imidazol-2-yl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-methyl-8-oxidanylidene-7-[(5-phenyl-4,5-dihydro-1H-imidazol-2-yl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H18N4O3S
MOLECULAR WEIGHT: 358.41482
SMILES: CC1=C(N2C(C(C2=O)NC3=NCC(N3)C4=CC=CC=C4)SC1)C(=O)O
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Product OPENEYE NAME: (2Z)-N-trimethylsilyl-2-trimethylsilyloxyimino-cyclohexanamine
CAS Name: (2Z)-N-trimethylsilyl-2-trimethylsilyloxyimino-1-cyclohexanamine
IUPAC NAME: (2Z)-N-trimethylsilyl-2-trimethylsilyloxyiminocyclohexan-1-amine
SYSTEMATIC NAME: (2Z)-N-trimethylsilyl-2-trimethylsilyloxyimino-cyclohexan-1-amine
MOLECULAR FORMULA: C12H28N2OSi2
MOLECULAR WEIGHT: 272.53452
SMILES: C[Si](C)(C)NC\1CCCC/C1=N/O[Si](C)(C)C
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