Wednesday, September 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: [(3S)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate
CAS Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(3S)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] ester
IUPAC NAME: [(3S)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
SYSTEMATIC NAME: [(3S)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate
MOLECULAR FORMULA: C37H49F3O3
MOLECULAR WEIGHT: 598.77837
SMILES: CCCCCCCCCC1CCC2C1(CCC3=C2C=CC4=C3CC[C@@H](C4)OC(=O)C(C5=CC=CC=C5)(C(F)(F)F)OC)C
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Product OPENEYE NAME: [(3R)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate
CAS Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(3R)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] ester
IUPAC NAME: [(3R)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
SYSTEMATIC NAME: [(3R)-13-methyl-17-nonyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate
MOLECULAR FORMULA: C37H49F3O3
MOLECULAR WEIGHT: 598.77837
SMILES: CCCCCCCCCC1CCC2C1(CCC3=C2C=CC4=C3CC[C@H](C4)OC(=O)C(C5=CC=CC=C5)(C(F)(F)F)OC)C
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Product OPENEYE NAME: [chloro(trifluoromethyl)-$l^{3}-iodanyl] nitrate
CAS Name: nitric acid [chloro(trifluoromethyl)-$l^{3}-iodanyl] ester
IUPAC NAME: [chloro(trifluoromethyl)-$l^{3}-iodanyl] nitrate
SYSTEMATIC NAME: [chloranyl(trifluoromethyl)-$l^{3}-iodanyl] nitrate
MOLECULAR FORMULA: CClF3INO3
MOLECULAR WEIGHT: 293.36828
SMILES: C(F)(F)(F)I(O[N+](=O)[O-])Cl
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Product OPENEYE NAME: [nitrooxy(trifluoromethyl)-$l^{3}-iodanyl] nitrate
CAS Name: nitric acid [nitrooxy(trifluoromethyl)-$l^{3}-iodanyl] ester
IUPAC NAME: [nitrooxy(trifluoromethyl)-$l^{3}-iodanyl] nitrate
SYSTEMATIC NAME: [nitrooxy(trifluoromethyl)-$l^{3}-iodanyl] nitrate
MOLECULAR FORMULA: CF3IN2O6
MOLECULAR WEIGHT: 319.92018
SMILES: C(F)(F)(F)I(O[N+](=O)[O-])O[N+](=O)[O-]
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Product OPENEYE NAME: [fluoro(trifluoromethyl)-$l^{3}-iodanyl] nitrate
CAS Name: nitric acid [fluoro(trifluoromethyl)-$l^{3}-iodanyl] ester
IUPAC NAME: [fluoro(trifluoromethyl)-$l^{3}-iodanyl] nitrate
SYSTEMATIC NAME: [fluoranyl(trifluoromethyl)-$l^{3}-iodanyl] nitrate
MOLECULAR FORMULA: CF4INO3
MOLECULAR WEIGHT: 276.913683
SMILES: C(F)(F)(F)I(O[N+](=O)[O-])F
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Product OPENEYE NAME: 1,1-difluoro-1-(pentafluoro-$l^{6}-sulfanyl)peroxy-N-(trifluoromethyl)methanamine
CAS Name: 1,1-difluoro-1-(pentafluoro-$l^{6}-sulfanyl)dioxy-N-(trifluoromethyl)methanamine
IUPAC NAME: 1,1-difluoro-1-(pentafluoro-$l^{6}-sulfanyl)peroxy-N-(trifluoromethyl)methanamine
SYSTEMATIC NAME: 1,1-bis(fluoranyl)-1-[pentakis(fluoranyl)-$l^{6}-sulfanyl]peroxy-N-(trifluoromethyl)methanamine
MOLECULAR FORMULA: C2HF10NO2S
MOLECULAR WEIGHT: 293.083872
SMILES: C(NC(F)(F)F)(OOS(F)(F)(F)(F)F)(F)F
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Product OPENEYE NAME: 1,1-difluoro-N-(trifluoromethyl)-1-(trifluoromethylperoxy)methanamine
CAS Name: 1,1-difluoro-N-(trifluoromethyl)-1-(trifluoromethyldioxy)methanamine
IUPAC NAME: 1,1-difluoro-N-(trifluoromethyl)-1-(trifluoromethylperoxy)methanamine
SYSTEMATIC NAME: 1,1-bis(fluoranyl)-N-(trifluoromethyl)-1-(trifluoromethylperoxy)methanamine
MOLECULAR FORMULA: C3HF8NO2
MOLECULAR WEIGHT: 235.032766
SMILES: C(NC(F)(F)F)(OOC(F)(F)F)(F)F
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Product OPENEYE NAME: 1,1,1-trifluoro-N-(trifluoromethyl)-N-(trifluoromethylsulfanyl)methanamine
CAS Name: 1,1,1-trifluoro-N,N-bis(trifluoromethyl)methanesulfenamide
IUPAC NAME: 1,1,1-trifluoro-N-(trifluoromethyl)-N-(trifluoromethylsulfanyl)methanamine
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)-N-(trifluoromethyl)-N-(trifluoromethylsulfanyl)methanamine
MOLECULAR FORMULA: C3F9NS
MOLECULAR WEIGHT: 253.089429
SMILES: C(N(C(F)(F)F)SC(F)(F)F)(F)(F)F
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Product OPENEYE NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitrous amide
CAS Name: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitrous amide
IUPAC NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitrous amide
SYSTEMATIC NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitrous amide
MOLECULAR FORMULA: C3F9N3O
MOLECULAR WEIGHT: 265.037229
SMILES: C(N(C(F)(F)F)N(C(F)(F)F)N=O)(F)(F)F
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Product OPENEYE NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitramide
CAS Name: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitramide
IUPAC NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitramide
SYSTEMATIC NAME: N-[bis(trifluoromethyl)amino]-N-(trifluoromethyl)nitramide
MOLECULAR FORMULA: C3F9N3O2
MOLECULAR WEIGHT: 281.036629
SMILES: C(N(C(F)(F)F)N(C(F)(F)F)[N+](=O)[O-])(F)(F)F
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Product OPENEYE NAME: 2-[bis(trifluoromethyl)amino]ethanol
CAS Name: 2-[bis(trifluoromethyl)amino]ethanol
IUPAC NAME: 2-[bis(trifluoromethyl)amino]ethanol
SYSTEMATIC NAME: 2-[bis(trifluoromethyl)amino]ethanol
MOLECULAR FORMULA: C4H5F6NO
MOLECULAR WEIGHT: 197.079019
SMILES: C(CO)N(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: (Z)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-1-amine
CAS Name: (Z)-1-fluoro-N,N-bis(trifluoromethyl)-1-propen-1-amine
IUPAC NAME: (Z)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-1-amine
SYSTEMATIC NAME: (Z)-1-fluoranyl-N,N-bis(trifluoromethyl)prop-1-en-1-amine
MOLECULAR FORMULA: C5H4F7N
MOLECULAR WEIGHT: 211.080782
SMILES: C/C=C(/N(C(F)(F)F)C(F)(F)F)\F
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Product OPENEYE NAME: (E)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-1-amine
CAS Name: (E)-1-fluoro-N,N-bis(trifluoromethyl)-1-propen-1-amine
IUPAC NAME: (E)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-1-amine
SYSTEMATIC NAME: (E)-1-fluoranyl-N,N-bis(trifluoromethyl)prop-1-en-1-amine
MOLECULAR FORMULA: C5H4F7N
MOLECULAR WEIGHT: 211.080782
SMILES: C/C=C(\N(C(F)(F)F)C(F)(F)F)/F
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Product OPENEYE NAME: (Z)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-2-amine
CAS Name: (Z)-1-fluoro-N,N-bis(trifluoromethyl)-1-propen-2-amine
IUPAC NAME: (Z)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-2-amine
SYSTEMATIC NAME: (Z)-1-fluoranyl-N,N-bis(trifluoromethyl)prop-1-en-2-amine
MOLECULAR FORMULA: C5H4F7N
MOLECULAR WEIGHT: 211.080782
SMILES: C/C(=C/F)/N(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: (E)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-2-amine
CAS Name: (E)-1-fluoro-N,N-bis(trifluoromethyl)-1-propen-2-amine
IUPAC NAME: (E)-1-fluoro-N,N-bis(trifluoromethyl)prop-1-en-2-amine
SYSTEMATIC NAME: (E)-1-fluoranyl-N,N-bis(trifluoromethyl)prop-1-en-2-amine
MOLECULAR FORMULA: C5H4F7N
MOLECULAR WEIGHT: 211.080782
SMILES: C/C(=C\F)/N(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: (1R,2S)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-1-amine
CAS Name: (1R,2S)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)-1-propanamine
IUPAC NAME: (1R,2S)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-1-amine
SYSTEMATIC NAME: (1R,2S)-2-bromanyl-1-fluoranyl-N,N-bis(trifluoromethyl)propan-1-amine
MOLECULAR FORMULA: C5H5BrF7N
MOLECULAR WEIGHT: 291.992722
SMILES: C[C@@H]([C@H](N(C(F)(F)F)C(F)(F)F)F)Br
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Product OPENEYE NAME: (1R,2R)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-1-amine
CAS Name: (1R,2R)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)-1-propanamine
IUPAC NAME: (1R,2R)-2-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-1-amine
SYSTEMATIC NAME: (1R,2R)-2-bromanyl-1-fluoranyl-N,N-bis(trifluoromethyl)propan-1-amine
MOLECULAR FORMULA: C5H5BrF7N
MOLECULAR WEIGHT: 291.992722
SMILES: C[C@H]([C@H](N(C(F)(F)F)C(F)(F)F)F)Br
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Product OPENEYE NAME: (1R,2S)-1-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-2-amine
CAS Name: (1R,2S)-1-bromo-1-fluoro-N,N-bis(trifluoromethyl)-2-propanamine
IUPAC NAME: (1R,2S)-1-bromo-1-fluoro-N,N-bis(trifluoromethyl)propan-2-amine
SYSTEMATIC NAME: (1R,2S)-1-bromanyl-1-fluoranyl-N,N-bis(trifluoromethyl)propan-2-amine
MOLECULAR FORMULA: C5H5BrF7N
MOLECULAR WEIGHT: 291.992722
SMILES: C[C@@H]([C@H](F)Br)N(C(F)(F)F)C(F)(F)F
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