Friday, August 16, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 4-amino-2-[bis[1-(dodecylamino)propyl]amino]-4-oxo-butanoic acid
CAS Name: 4-amino-2-[bis[1-(dodecylamino)propyl]amino]-4-oxobutanoic acid
IUPAC NAME: 4-amino-2-[bis[1-(dodecylamino)propyl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-azanyl-2-[bis[1-(dodecylamino)propyl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C34H70N4O3
MOLECULAR WEIGHT: 582.9446
SMILES: CCCCCCCCCCCCNC(CC)N(C(CC)NCCCCCCCCCCCC)C(CC(=O)N)C(=O)O
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Product OPENEYE NAME: 2-[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-cyclohexa-1,3-dien-1-yl]oxybutanoic acid
CAS Name: 2-[[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-1-cyclohexa-1,3-dienyl]oxy]butanoic acid
IUPAC NAME: 2-[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxocyclohexa-1,3-dien-1-yl]oxybutanoic acid
SYSTEMATIC NAME: 2-[(5Z)-5-[3,5-bis(chloranyl)-1H-pyridin-2-ylidene]-2-chloranyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]oxybutanoic acid
MOLECULAR FORMULA: C15H12Cl3NO4
MOLECULAR WEIGHT: 376.61908
SMILES: CCC(C(=O)O)OC1=C(C=C/C(=C/2\C(=CC(=CN2)Cl)Cl)/C1=O)Cl
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Product OPENEYE NAME: 2-[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-cyclohexa-1,3-dien-1-yl]oxypropanoic acid
CAS Name: 2-[[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-1-cyclohexa-1,3-dienyl]oxy]propanoic acid
IUPAC NAME: 2-[(5Z)-2-chloro-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxocyclohexa-1,3-dien-1-yl]oxypropanoic acid
SYSTEMATIC NAME: 2-[(5Z)-5-[3,5-bis(chloranyl)-1H-pyridin-2-ylidene]-2-chloranyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]oxypropanoic acid
MOLECULAR FORMULA: C14H10Cl3NO4
MOLECULAR WEIGHT: 362.5925
SMILES: CC(C(=O)O)OC1=C(C=C/C(=C/2\C(=CC(=CN2)Cl)Cl)/C1=O)Cl
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Product OPENEYE NAME: 2-[(5Z)-2-bromo-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-cyclohexa-1,3-dien-1-yl]oxypropanoic acid
CAS Name: 2-[[(5Z)-2-bromo-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxo-1-cyclohexa-1,3-dienyl]oxy]propanoic acid
IUPAC NAME: 2-[(5Z)-2-bromo-5-(3,5-dichloro-1H-pyridin-2-ylidene)-6-oxocyclohexa-1,3-dien-1-yl]oxypropanoic acid
SYSTEMATIC NAME: 2-[(5Z)-5-[3,5-bis(chloranyl)-1H-pyridin-2-ylidene]-2-bromanyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]oxypropanoic acid
MOLECULAR FORMULA: C14H10BrCl2NO4
MOLECULAR WEIGHT: 407.0435
SMILES: CC(C(=O)O)OC1=C(C=C/C(=C/2\C(=CC(=CN2)Cl)Cl)/C1=O)Br
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Product OPENEYE NAME: 2-[(5Z)-5-[3-chloro-5-(trifluoromethyl)-1H-pyridin-2-ylidene]-2-nitro-6-oxo-cyclohexa-1,3-dien-1-yl]oxybutanoic acid
CAS Name: 2-[[(5Z)-5-[3-chloro-5-(trifluoromethyl)-1H-pyridin-2-ylidene]-2-nitro-6-oxo-1-cyclohexa-1,3-dienyl]oxy]butanoic acid
IUPAC NAME: 2-[(5Z)-5-[3-chloro-5-(trifluoromethyl)-1H-pyridin-2-ylidene]-2-nitro-6-oxocyclohexa-1,3-dien-1-yl]oxybutanoic acid
SYSTEMATIC NAME: 2-[(5Z)-5-[3-chloranyl-5-(trifluoromethyl)-1H-pyridin-2-ylidene]-2-nitro-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]oxybutanoic acid
MOLECULAR FORMULA: C16H12ClF3N2O6
MOLECULAR WEIGHT: 420.72449
SMILES: CCC(C(=O)O)OC1=C(C=C/C(=C/2\C(=CC(=CN2)C(F)(F)F)Cl)/C1=O)[N+](=O)[O-]
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Product OPENEYE NAME: 3,4-dihydro-1,2-benzodioxin-5-yl N-methylcarbamate
CAS Name: N-methylcarbamic acid 3,4-dihydro-1,2-benzodioxin-5-yl ester
IUPAC NAME: 3,4-dihydro-1,2-benzodioxin-5-yl N-methylcarbamate
SYSTEMATIC NAME: 3,4-dihydro-1,2-benzodioxin-5-yl N-methylcarbamate
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: CNC(=O)OC1=CC=CC2=C1CCOO2
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Product OPENEYE NAME: N-[4-chloro-2-(4-chlorophenyl)sulfonyl-phenyl]carbamate
CAS Name: N-[4-chloro-2-(4-chlorophenyl)sulfonylphenyl]carbamate
IUPAC NAME: N-[4-chloro-2-(4-chlorophenyl)sulfonylphenyl]carbamate
SYSTEMATIC NAME: N-[4-chloranyl-2-(4-chlorophenyl)sulfonyl-phenyl]carbamate
MOLECULAR FORMULA: C13H8Cl2NO4S-
MOLECULAR WEIGHT: 345.17792
SMILES: C1=CC(=CC=C1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)[O-])Cl
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Product OPENEYE NAME: [4-chloro-2-(4-chlorophenyl)sulfonyl-phenyl]carbamic acid
CAS Name: [4-chloro-2-(4-chlorophenyl)sulfonylphenyl]carbamic acid
IUPAC NAME: [4-chloro-2-(4-chlorophenyl)sulfonylphenyl]carbamic acid
SYSTEMATIC NAME: [4-chloranyl-2-(4-chlorophenyl)sulfonyl-phenyl]carbamic acid
MOLECULAR FORMULA: C13H9Cl2NO4S
MOLECULAR WEIGHT: 346.18586
SMILES: C1=CC(=CC=C1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)O)Cl
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Product OPENEYE NAME: N-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butanamide
CAS Name: N-(1-cyclohexa-1,5-dienyl)-3,3-dimethylbutanamide
IUPAC NAME: N-cyclohexa-1,5-dien-1-yl-3,3-dimethylbutanamide
SYSTEMATIC NAME: N-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butanamide
MOLECULAR FORMULA: C12H19NO
MOLECULAR WEIGHT: 193.28536
SMILES: CC(C)(C)CC(=O)NC1=CCCC=C1
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Product OPENEYE NAME: 1,4-di(tetrahydropyran-2-yl)butan-2-ol
CAS Name: 1,4-bis(2-oxanyl)-2-butanol
IUPAC NAME: 1,4-bis(oxan-2-yl)butan-2-ol
SYSTEMATIC NAME: 1,4-bis(oxan-2-yl)butan-2-ol
MOLECULAR FORMULA: C14H26O3
MOLECULAR WEIGHT: 242.35444
SMILES: C1CCOC(C1)CCC(CC2CCCCO2)O
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Product OPENEYE NAME: 1,4-di(tetrahydrofuran-2-yl)butan-2-ol
CAS Name: 1,4-bis(2-oxolanyl)-2-butanol
IUPAC NAME: 1,4-bis(oxolan-2-yl)butan-2-ol
SYSTEMATIC NAME: 1,4-bis(oxolan-2-yl)butan-2-ol
MOLECULAR FORMULA: C12H22O3
MOLECULAR WEIGHT: 214.30128
SMILES: C1CC(OC1)CCC(CC2CCCO2)O
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Product OPENEYE NAME: 1-propylsulfanylxanthen-9-one
CAS Name: 1-(propylthio)-9-xanthenone
IUPAC NAME: 1-propylsulfanylxanthen-9-one
SYSTEMATIC NAME: 1-propylsulfanylxanthen-9-one
MOLECULAR FORMULA: C16H14O2S
MOLECULAR WEIGHT: 270.34616
SMILES: CCCSC1=CC=CC2=C1C(=O)C3=CC=CC=C3O2
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Product OPENEYE NAME: xanthen-9-one
CAS Name: 9-xanthenone
IUPAC NAME: xanthen-9-one
SYSTEMATIC NAME: xanthen-9-one
MOLECULAR FORMULA: C26H16O4
MOLECULAR WEIGHT: 392.40284
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3O2.C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3O2
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