Wednesday, August 10, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 4-acetyl-8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: 4-acetyl-8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: 4-acetyl-8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 4-ethanoyl-8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C11H16N2O3
MOLECULAR WEIGHT: 224.25634
SMILES: CC1CCC2(CC1)C(=O)NC(=O)N2C(=O)C
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Product OPENEYE NAME: 2-allyl-2,4-diazaspiro[4.6]undecane-1,3-dione
CAS Name: 2-prop-2-enyl-2,4-diazaspiro[4.6]undecane-1,3-dione
IUPAC NAME: 2-prop-2-enyl-2,4-diazaspiro[4.6]undecane-1,3-dione
SYSTEMATIC NAME: 2-prop-2-enyl-2,4-diazaspiro[4.6]undecane-1,3-dione
MOLECULAR FORMULA: C12H18N2O2
MOLECULAR WEIGHT: 222.28352
SMILES: C=CCN1C(=O)C2(CCCCCC2)NC1=O
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Product OPENEYE NAME: 2-(2-hydroxyethyl)-2,4-diazaspiro[4.6]undecane-1,3-dione
CAS Name: 2-(2-hydroxyethyl)-2,4-diazaspiro[4.6]undecane-1,3-dione
IUPAC NAME: 2-(2-hydroxyethyl)-2,4-diazaspiro[4.6]undecane-1,3-dione
SYSTEMATIC NAME: 2-(2-hydroxyethyl)-2,4-diazaspiro[4.6]undecane-1,3-dione
MOLECULAR FORMULA: C11H18N2O3
MOLECULAR WEIGHT: 226.27222
SMILES: C1CCCC2(CC1)C(=O)N(C(=O)N2)CCO
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Product OPENEYE NAME: 2,6-ditert-butyl-1,4-benzoquinone
CAS Name: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C14H20O2
MOLECULAR WEIGHT: 220.3074
SMILES: CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
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Product OPENEYE NAME: 2,3,5,6-tetrachlorobenzene-1,4-dicarbonyl chloride
CAS Name: 2,3,5,6-tetrachlorobenzene-1,4-dicarbonyl chloride
IUPAC NAME: 2,3,5,6-tetrachlorobenzene-1,4-dicarbonyl chloride
SYSTEMATIC NAME: 2,3,5,6-tetrakis(chloranyl)benzene-1,4-dicarbonyl chloride
MOLECULAR FORMULA: C8Cl6O2
MOLECULAR WEIGHT: 340.8024
SMILES: C1(=C(C(=C(C(=C1Cl)Cl)C(=O)Cl)Cl)Cl)C(=O)Cl
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Product OPENEYE NAME: 2-chloro-4-(methoxymethyl)-6-methyl-5-nitro-pyridine-3-carbonitrile
CAS Name: 2-chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile
IUPAC NAME: 2-chloro-4-(methoxymethyl)-6-methyl-5-nitropyridine-3-carbonitrile
SYSTEMATIC NAME: 2-chloranyl-4-(methoxymethyl)-6-methyl-5-nitro-pyridine-3-carbonitrile
MOLECULAR FORMULA: C9H8ClN3O3
MOLECULAR WEIGHT: 241.63112
SMILES: CC1=C(C(=C(C(=N1)Cl)C#N)COC)[N+](=O)[O-]
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Product OPENEYE NAME: (2-amino-5-chloro-phenyl)-phenyl-methanone
CAS Name: (2-amino-5-chlorophenyl)-phenylmethanone
IUPAC NAME: (2-amino-5-chlorophenyl)-phenylmethanone
SYSTEMATIC NAME: (2-azanyl-5-chloranyl-phenyl)-phenyl-methanone
MOLECULAR FORMULA: C13H10ClNO
MOLECULAR WEIGHT: 231.6776
SMILES: C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)N
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Product OPENEYE NAME: N2,N4-diethyl-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
CAS Name: N2,N4-diethyl-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 2-N,4-N-diethyl-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2,N4-diethyl-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C8H12F3N5
MOLECULAR WEIGHT: 235.20959
SMILES: CCNC1=NC(=NC(=N1)C(F)(F)F)NCC
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Product OPENEYE NAME: [3-(5-nitro-2-furyl)prop-2-enylideneamino]urea
CAS Name: [3-(5-nitro-2-furanyl)prop-2-enylideneamino]urea
IUPAC NAME: [3-(5-nitrofuran-2-yl)prop-2-enylideneamino]urea
SYSTEMATIC NAME: 1-[3-(5-nitrofuran-2-yl)prop-2-enylideneamino]urea
MOLECULAR FORMULA: C8H8N4O4
MOLECULAR WEIGHT: 224.17352
SMILES: C1=C(OC(=C1)[N+](=O)[O-])C=CC=NNC(=O)N
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Product OPENEYE NAME: 4-(m-tolylazo)aniline
CAS Name: 4-(3-methylphenyl)azoaniline
IUPAC NAME: 4-[(3-methylphenyl)diazenyl]aniline
SYSTEMATIC NAME: 4-[(3-methylphenyl)diazenyl]aniline
MOLECULAR FORMULA: C13H13N3
MOLECULAR WEIGHT: 211.26242
SMILES: CC1=CC(=CC=C1)N=NC2=CC=C(C=C2)N
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Product OPENEYE NAME: 4-(p-tolylazo)aniline
CAS Name: 4-(4-methylphenyl)azoaniline
IUPAC NAME: 4-[(4-methylphenyl)diazenyl]aniline
SYSTEMATIC NAME: 4-[(4-methylphenyl)diazenyl]aniline
MOLECULAR FORMULA: C13H13N3
MOLECULAR WEIGHT: 211.26242
SMILES: CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N
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Product OPENEYE NAME: 4-[(4-aminophenyl)disulfanyl]aniline
CAS Name: 4-[(4-aminophenyl)disulfanyl]aniline
IUPAC NAME: 4-[(4-aminophenyl)disulfanyl]aniline
SYSTEMATIC NAME: 4-[(4-aminophenyl)disulfanyl]aniline
MOLECULAR FORMULA: C12H12N2S2
MOLECULAR WEIGHT: 248.36708
SMILES: C1=CC(=CC=C1N)SSC2=CC=C(C=C2)N
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Product OPENEYE NAME: diphenyliodonium nitrate
CAS Name: diphenyliodonium nitrate
IUPAC NAME: diphenyliodanium nitrate
SYSTEMATIC NAME: diphenyliodanium nitrate
MOLECULAR FORMULA: C12H10INO3
MOLECULAR WEIGHT: 343.11717
SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[N+](=O)([O-])[O-]
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Product OPENEYE NAME: diphenyliodonium
CAS Name: diphenyliodonium
IUPAC NAME: diphenyliodanium
SYSTEMATIC NAME: diphenyliodanium
MOLECULAR FORMULA: C12H10I+
MOLECULAR WEIGHT: 281.11227
SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2
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Product OPENEYE NAME: nitric acid; 2-(p-tolylmethoxy)guanidine
CAS Name: 2-[(4-methylphenyl)methoxy]guanidine; nitric acid
IUPAC NAME: 2-[(4-methylphenyl)methoxy]guanidine; nitric acid
SYSTEMATIC NAME: 2-[(4-methylphenyl)methoxy]guanidine; nitric acid
MOLECULAR FORMULA: C9H14N4O4
MOLECULAR WEIGHT: 242.23186
SMILES: CC1=CC=C(C=C1)CON=C(N)N.[N+](=O)(O)[O-]
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Product OPENEYE NAME: 2-(p-tolylmethoxy)guanidine
CAS Name: 2-[(4-methylphenyl)methoxy]guanidine
IUPAC NAME: 2-[(4-methylphenyl)methoxy]guanidine
SYSTEMATIC NAME: 2-[(4-methylphenyl)methoxy]guanidine
MOLECULAR FORMULA: C9H13N3O
MOLECULAR WEIGHT: 179.21902
SMILES: CC1=CC=C(C=C1)CON=C(N)N
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Product OPENEYE NAME: 5,5-diallyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione
CAS Name: 1,3-dimethyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
IUPAC NAME: 1,3-dimethyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1,3-dimethyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C12H16N2O3
MOLECULAR WEIGHT: 236.26704
SMILES: CN1C(=O)C(C(=O)N(C1=O)C)(CC=C)CC=C
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Product OPENEYE NAME: 4-methyl-2-(oxiran-2-ylmethyl)-2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: 4-methyl-2-(2-oxiranylmethyl)-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: 4-methyl-2-(oxiran-2-ylmethyl)-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 4-methyl-2-(oxiran-2-ylmethyl)-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C12H18N2O3
MOLECULAR WEIGHT: 238.28292
SMILES: CN1C(=O)N(C(=O)C12CCCCC2)CC3CO3
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