Tuesday, September 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H14F6
MOLECULAR WEIGHT: 296.251379
SMILES: C1CCCC2=C([C@]3(C(=C([C@@H]([C@]3([C@@H]2CC1)F)F)F)F)F)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H14F6
MOLECULAR WEIGHT: 296.251379
SMILES: C1CCCC2=C([C@]3(C(=C([C@@H]([C@]3([C@H]2CC1)F)F)F)F)F)F
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Product OPENEYE NAME: 2,3,5,6-tetrafluoro-4-[3,3,4,4-tetrafluoro-2-(2,3,5,6-tetrafluoro-4-pyridyl)cyclobuten-1-yl]pyridine
CAS Name: 2,3,5,6-tetrafluoro-4-[3,3,4,4-tetrafluoro-2-(2,3,5,6-tetrafluoro-4-pyridinyl)-1-cyclobutenyl]pyridine
IUPAC NAME: 2,3,5,6-tetrafluoro-4-[3,3,4,4-tetrafluoro-2-(2,3,5,6-tetrafluoropyridin-4-yl)cyclobuten-1-yl]pyridine
SYSTEMATIC NAME: 2,3,5,6-tetrakis(fluoranyl)-4-[3,3,4,4-tetrakis(fluoranyl)-2-[2,3,5,6-tetrakis(fluoranyl)pyridin-4-yl]cyclobuten-1-yl]pyridine
MOLECULAR FORMULA: C14F12N2
MOLECULAR WEIGHT: 424.144038
SMILES: C1(=C(C(=NC(=C1F)F)F)F)C2=C(C(C2(F)F)(F)F)C3=C(C(=NC(=C3F)F)F)F
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Product OPENEYE NAME: 2,3,5,6-tetrafluoro-4-[1,2,2,3,3,4-hexafluoro-4-(2,3,5,6-tetrafluoro-4-pyridyl)cyclobutyl]pyridine
CAS Name: 2,3,5,6-tetrafluoro-4-[1,2,2,3,3,4-hexafluoro-4-(2,3,5,6-tetrafluoro-4-pyridinyl)cyclobutyl]pyridine
IUPAC NAME: 2,3,5,6-tetrafluoro-4-[1,2,2,3,3,4-hexafluoro-4-(2,3,5,6-tetrafluoropyridin-4-yl)cyclobutyl]pyridine
SYSTEMATIC NAME: 2,3,5,6-tetrakis(fluoranyl)-4-[1,2,2,3,3,4-hexakis(fluoranyl)-4-[2,3,5,6-tetrakis(fluoranyl)pyridin-4-yl]cyclobutyl]pyridine
MOLECULAR FORMULA: C14F14N2
MOLECULAR WEIGHT: 462.140845
SMILES: C1(=C(C(=NC(=C1F)F)F)F)C2(C(C(C2(F)F)(F)F)(C3=C(C(=NC(=C3F)F)F)F)F)F
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Product OPENEYE NAME: (1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)methyl 1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexanecarboxylate
CAS Name: 1,2,2,3,3,4,4,5,5,6,6-undecafluoro-1-cyclohexanecarboxylic acid (1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)methyl ester
IUPAC NAME: (1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)methyl 1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexane-1-carboxylate
SYSTEMATIC NAME: [1,2,2,3,3,4,4,5,5,6,6-undecakis(fluoranyl)cyclohexyl]methyl 1,2,2,3,3,4,4,5,5,6,6-undecakis(fluoranyl)cyclohexane-1-carboxylate
MOLECULAR FORMULA: C14H2F22O2
MOLECULAR WEIGHT: 620.12935
SMILES: C(C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)F)OC(=O)C2(C(C(C(C(C2(F)F)(F)F)(F)F)(F)F)(F)F)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H25FO
MOLECULAR WEIGHT: 240.356803
SMILES: C[C@]12CC[C@]([C@H]1F)([C@H]([C@H]3[C@@H]2CC(C3)(C)C)O)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H2F16
MOLECULAR WEIGHT: 486.150831
SMILES: C12C(C3(C4=C(C1(C(C3(F)F)(F)F)F)C(=C(C(=C4F)F)F)F)F)C(C(C2(F)F)(F)F)(F)F
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Product OPENEYE NAME: (2S,3R)-6-fluoro-2,5-diphenyl-spiro[2.3]hex-5-ene
CAS Name: (2S,3R)-6-fluoro-2,5-diphenylspiro[2.3]hex-5-ene
IUPAC NAME: (2S,3R)-6-fluoro-2,5-diphenylspiro[2.3]hex-5-ene
SYSTEMATIC NAME: (2S,3R)-6-fluoranyl-2,5-diphenyl-spiro[2.3]hex-5-ene
MOLECULAR FORMULA: C18H15F
MOLECULAR WEIGHT: 250.310103
SMILES: C1[C@H]([C@]12CC(=C2F)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (2R,3R)-6-fluoro-2,5-diphenyl-spiro[2.3]hex-5-ene
CAS Name: (2R,3R)-6-fluoro-2,5-diphenylspiro[2.3]hex-5-ene
IUPAC NAME: (2R,3R)-6-fluoro-2,5-diphenylspiro[2.3]hex-5-ene
SYSTEMATIC NAME: (2R,3R)-6-fluoranyl-2,5-diphenyl-spiro[2.3]hex-5-ene
MOLECULAR FORMULA: C18H15F
MOLECULAR WEIGHT: 250.310103
SMILES: C1[C@@H]([C@]12CC(=C2F)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: [4-(4-fluoro-1-bicyclo[2.2.2]octanyl)phenyl]ammonium
CAS Name: [4-(4-fluoro-1-bicyclo[2.2.2]octanyl)phenyl]ammonium
IUPAC NAME: [4-(4-fluoro-1-bicyclo[2.2.2]octanyl)phenyl]azanium
SYSTEMATIC NAME: [4-(4-fluoranyl-1-bicyclo[2.2.2]octanyl)phenyl]azanium
MOLECULAR FORMULA: C14H19FN+
MOLECULAR WEIGHT: 220.305763
SMILES: C1CC2(CCC1(CC2)C3=CC=C(C=C3)[NH3+])F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H6F14
MOLECULAR WEIGHT: 464.196485
SMILES: CC1=C(C2(C3=C(C1(C(C2(F)F)(F)F)F)C(=C(C4(C3(C(C4(F)F)(F)F)F)F)F)F)F)C
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Product OPENEYE NAME: N-[(E)-(2-fluoro-3-phenyl-cyclobut-2-en-1-ylidene)amino]-4-methyl-benzenesulfonamide
CAS Name: N-[(E)-(2-fluoro-3-phenyl-1-cyclobut-2-enylidene)amino]-4-methylbenzenesulfonamide
IUPAC NAME: N-[(E)-(2-fluoro-3-phenylcyclobut-2-en-1-ylidene)amino]-4-methylbenzenesulfonamide
SYSTEMATIC NAME: N-[(E)-(2-fluoranyl-3-phenyl-cyclobut-2-en-1-ylidene)amino]-4-methyl-benzenesulfonamide
MOLECULAR FORMULA: C17H15FN2O2S
MOLECULAR WEIGHT: 330.376603
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N/N=C/2\CC(=C2F)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(2-fluoro-3-phenyl-cyclobut-2-en-1-yl)sulfonyl-4-methyl-benzene
CAS Name: 1-[(2-fluoro-3-phenyl-1-cyclobut-2-enyl)sulfonyl]-4-methylbenzene
IUPAC NAME: 1-(2-fluoro-3-phenylcyclobut-2-en-1-yl)sulfonyl-4-methylbenzene
SYSTEMATIC NAME: 1-(2-fluoranyl-3-phenyl-cyclobut-2-en-1-yl)sulfonyl-4-methyl-benzene
MOLECULAR FORMULA: C17H15FO2S
MOLECULAR WEIGHT: 302.363203
SMILES: CC1=CC=C(C=C1)S(=O)(=O)C2CC(=C2F)C3=CC=CC=C3
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