Tuesday, August 2, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1,1-dipropylguanidine; nitric acid
CAS Name: 1,1-dipropylguanidine; nitric acid
IUPAC NAME: 1,1-dipropylguanidine; nitric acid
SYSTEMATIC NAME: 1,1-dipropylguanidine; nitric acid
MOLECULAR FORMULA: C7H18N4O3
MOLECULAR WEIGHT: 206.24282
SMILES: CCCN(CCC)C(=N)N.[N+](=O)(O)[O-]
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Product OPENEYE NAME: 1,1-dipropylguanidine
CAS Name: 1,1-dipropylguanidine
IUPAC NAME: 1,1-dipropylguanidine
SYSTEMATIC NAME: 1,1-dipropylguanidine
MOLECULAR FORMULA: C7H17N3
MOLECULAR WEIGHT: 143.22998
SMILES: CCCN(CCC)C(=N)N
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Product OPENEYE NAME: 1,1-dibutylguanidine; nitric acid
CAS Name: 1,1-dibutylguanidine; nitric acid
IUPAC NAME: 1,1-dibutylguanidine; nitric acid
SYSTEMATIC NAME: 1,1-dibutylguanidine; nitric acid
MOLECULAR FORMULA: C9H22N4O3
MOLECULAR WEIGHT: 234.29598
SMILES: CCCCN(CCCC)C(=N)N.[N+](=O)(O)[O-]
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Product OPENEYE NAME: 1,1-dibutylguanidine
CAS Name: 1,1-dibutylguanidine
IUPAC NAME: 1,1-dibutylguanidine
SYSTEMATIC NAME: 1,1-dibutylguanidine
MOLECULAR FORMULA: C9H21N3
MOLECULAR WEIGHT: 171.28314
SMILES: CCCCN(CCCC)C(=N)N
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Product OPENEYE NAME: 1-(4-fluorophenyl)ethanone oxime
CAS Name: 1-(4-fluorophenyl)ethanone oxime
IUPAC NAME: N-[1-(4-fluorophenyl)ethylidene]hydroxylamine
SYSTEMATIC NAME: N-[1-(4-fluorophenyl)ethylidene]hydroxylamine
MOLECULAR FORMULA: C8H8FNO
MOLECULAR WEIGHT: 153.153623
SMILES: CC(=NO)C1=CC=C(C=C1)F
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Product OPENEYE NAME: N-(cyclopentylideneamino)-4-nitro-benzamide
CAS Name: N-(cyclopentylideneamino)-4-nitrobenzamide
IUPAC NAME: N-(cyclopentylideneamino)-4-nitrobenzamide
SYSTEMATIC NAME: N-(cyclopentylideneamino)-4-nitro-benzamide
MOLECULAR FORMULA: C12H13N3O3
MOLECULAR WEIGHT: 247.24992
SMILES: C1CCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C1
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Product OPENEYE NAME: N-(cyclohexylideneamino)-4-nitro-benzamide
CAS Name: N-(cyclohexylideneamino)-4-nitrobenzamide
IUPAC NAME: N-(cyclohexylideneamino)-4-nitrobenzamide
SYSTEMATIC NAME: N-(cyclohexylideneamino)-4-nitro-benzamide
MOLECULAR FORMULA: C13H15N3O3
MOLECULAR WEIGHT: 261.2765
SMILES: C1CCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC1
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Product OPENEYE NAME: 6-aminopyridine-3-carboxamide
CAS Name: 6-amino-3-pyridinecarboxamide
IUPAC NAME: 6-aminopyridine-3-carboxamide
SYSTEMATIC NAME: 6-azanylpyridine-3-carboxamide
MOLECULAR FORMULA: C6H7N3O
MOLECULAR WEIGHT: 137.13928
SMILES: C1=CC(=NC=C1C(=O)N)N
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Product OPENEYE NAME: 3-(3-fluorophenyl)-1,1-dimethyl-urea
CAS Name: 3-(3-fluorophenyl)-1,1-dimethylurea
IUPAC NAME: 3-(3-fluorophenyl)-1,1-dimethylurea
SYSTEMATIC NAME: 3-(3-fluorophenyl)-1,1-dimethyl-urea
MOLECULAR FORMULA: C9H11FN2O
MOLECULAR WEIGHT: 182.194843
SMILES: CN(C)C(=O)NC1=CC(=CC=C1)F
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Product OPENEYE NAME: 3-(3,4-dichlorophenyl)-1-methoxy-1-methyl-urea
CAS Name: 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea
IUPAC NAME: 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea
SYSTEMATIC NAME: 3-(3,4-dichlorophenyl)-1-methoxy-1-methyl-urea
MOLECULAR FORMULA: C9H10Cl2N2O2
MOLECULAR WEIGHT: 249.0939
SMILES: CN(C(=O)NC1=CC(=C(C=C1)Cl)Cl)OC
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Product OPENEYE NAME: (3,5-diisopropylphenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid [3,5-di(propan-2-yl)phenyl] ester
IUPAC NAME: [3,5-di(propan-2-yl)phenyl] N-methylcarbamate
SYSTEMATIC NAME: [3,5-di(propan-2-yl)phenyl] N-methylcarbamate
MOLECULAR FORMULA: C14H21NO2
MOLECULAR WEIGHT: 235.32204
SMILES: CC(C)C1=CC(=CC(=C1)OC(=O)NC)C(C)C
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Product OPENEYE NAME: 2-fluoro-N-phenyl-acetamide
CAS Name: 2-fluoro-N-phenylacetamide
IUPAC NAME: 2-fluoro-N-phenylacetamide
SYSTEMATIC NAME: 2-fluoranyl-N-phenyl-ethanamide
MOLECULAR FORMULA: C8H8FNO
MOLECULAR WEIGHT: 153.153623
SMILES: C1=CC=C(C=C1)NC(=O)CF
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Product OPENEYE NAME: 1-benzyl-1-methyl-guanidine hydrochloride
CAS Name: 1-methyl-1-(phenylmethyl)guanidine hydrochloride
IUPAC NAME: 1-benzyl-1-methylguanidine hydrochloride
SYSTEMATIC NAME: 1-methyl-1-(phenylmethyl)guanidine hydrochloride
MOLECULAR FORMULA: C9H14ClN3
MOLECULAR WEIGHT: 199.68056
SMILES: CN(CC1=CC=CC=C1)C(=N)N.Cl
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Product OPENEYE NAME: 1-benzyl-1-methyl-guanidine
CAS Name: 1-methyl-1-(phenylmethyl)guanidine
IUPAC NAME: 1-benzyl-1-methylguanidine
SYSTEMATIC NAME: 1-methyl-1-(phenylmethyl)guanidine
MOLECULAR FORMULA: C9H13N3
MOLECULAR WEIGHT: 163.21962
SMILES: CN(CC1=CC=CC=C1)C(=N)N
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Product OPENEYE NAME: 1,3-bis(4-nitrophenyl)urea; 4,6-dimethyl-1H-pyrimidin-2-one
CAS Name: 1,3-bis(4-nitrophenyl)urea; 4,6-dimethyl-1H-pyrimidin-2-one
IUPAC NAME: 1,3-bis(4-nitrophenyl)urea; 4,6-dimethyl-1H-pyrimidin-2-one
SYSTEMATIC NAME: 1,3-bis(4-nitrophenyl)urea; 4,6-dimethyl-1H-pyrimidin-2-one
MOLECULAR FORMULA: C19H18N6O6
MOLECULAR WEIGHT: 426.38282
SMILES: CC1=CC(=NC(=O)N1)C.C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 4,6-dimethyl-1H-pyrimidin-2-one
CAS Name: 4,6-dimethyl-1H-pyrimidin-2-one
IUPAC NAME: 4,6-dimethyl-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-dimethyl-1H-pyrimidin-2-one
MOLECULAR FORMULA: C6H8N2O
MOLECULAR WEIGHT: 124.14052
SMILES: CC1=CC(=NC(=O)N1)C
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Product OPENEYE NAME: 1,3-bis(4-nitrophenyl)urea
CAS Name: 1,3-bis(4-nitrophenyl)urea
IUPAC NAME: 1,3-bis(4-nitrophenyl)urea
SYSTEMATIC NAME: 1,3-bis(4-nitrophenyl)urea
MOLECULAR FORMULA: C13H10N4O5
MOLECULAR WEIGHT: 302.2423
SMILES: C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 3-chloro-N-(2,2-difluoroethyl)aniline
CAS Name: 3-chloro-N-(2,2-difluoroethyl)aniline
IUPAC NAME: 3-chloro-N-(2,2-difluoroethyl)aniline
SYSTEMATIC NAME: N-[2,2-bis(fluoranyl)ethyl]-3-chloranyl-aniline
MOLECULAR FORMULA: C8H8ClF2N
MOLECULAR WEIGHT: 191.605626
SMILES: C1=CC(=CC(=C1)Cl)NCC(F)F
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