Tuesday, November 1, 2011

http://ChemLookup.com Compounds




CAS RN: 76402-66-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H42O10
MOLECULAR WEIGHT: 586.66988
SMILES: CCCCC/C=C/C=C/[C@]12O[C@@H]3[C@@H]4[C@H]5[C@](O5)([C@H]([C@]6([C@H]([C@@]4(O1)[C@@H]([C@H]([C@@]3(O2)C(=C)C)OC(=O)C)C)C=C(C6=O)C)O)O)CO
Structure:

CAS RN: 76095-56-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H44ClN3O7
MOLECULAR WEIGHT: 690.22486
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 75983-74-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H44ClN3O10
MOLECULAR WEIGHT: 678.16956
SMILES: CC1C2CC(C(/C=C\C=C(/CC3=CC(=C(C=C3NC(=O)CC(C4(C1O4)C)OC(=O)C(C)N(C)C(=O)C)Cl)OC)\C)OC)(NC(=O)O2)O
Structure:

CAS RN: 75705-48-5
CAS Name: propanoic acid [(2E)-3,7-dimethylocta-2,7-dienyl] ester
OPENEYE Name: [(2E)-3,7-dimethylocta-2,7-dienyl] propanoate
IUPAC Name: [(2E)-3,7-dimethylocta-2,7-dienyl] propanoate
SYSTEMATIC NAME: [(2E)-3,7-dimethylocta-2,7-dienyl] propanoate
MOLECULAR FORMULA: C13H22O2
MOLECULAR WEIGHT: 210.31258
SMILES: CCC(=O)OC/C=C(\C)/CCCC(=C)C
Structure:

CAS RN: 75044-72-3
CAS Name: (1S,4aS,7R,7aS)-7-hydroxy-7-[[(Z)-3-(4-hydroxyphenyl)-1-oxoprop-2-enoxy]methyl]-1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid
OPENEYE Name: (1S,4aS,7R,7aS)-7-hydroxy-7-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid
IUPAC Name: (1S,4aS,7R,7aS)-7-hydroxy-7-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid
SYSTEMATIC NAME: (1S,4aS,7R,7aS)-1-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-7-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-7-oxidanyl-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid
MOLECULAR FORMULA: C25H28O13
MOLECULAR WEIGHT: 536.48202
SMILES: C1=C[C@@]([C@@H]2[C@H]1C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O)(COC(=O)/C=C\C4=CC=C(C=C4)O)O
Structure:

CAS RN: 112839-35-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H21NO
MOLECULAR WEIGHT: 279.37614
SMILES: CNCC/C=C/1\C2=CC=CC=C2CC(C3=CC=CC=C31)O
Structure:

CAS RN: 47132-16-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H21NO
MOLECULAR WEIGHT: 279.37614
SMILES: CNCC/C=C/1\C2=CC=CC=C2CC(C3=CC=CC=C31)O
Structure:

CAS RN: 37439-90-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H25NO5
MOLECULAR WEIGHT: 395.4483
SMILES: CNCC/C=C/1\C2=CC=CC=C2CC(C3=CC=CC=C31)O.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 74853-74-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H25NO5
MOLECULAR WEIGHT: 395.4483
SMILES: CNCC/C=C/1\C2=CC=CC=C2CC(C3=CC=CC=C31)O.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 74193-14-9
CAS Name: (2E,4E,6E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6-trien-8-ynoic acid
OPENEYE Name: (2E,4E,6E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6-trien-8-ynoic acid
IUPAC Name: (2E,4E,6E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6-trien-8-ynoic acid
SYSTEMATIC NAME: (2E,4E,6E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6-trien-8-ynoic acid
MOLECULAR FORMULA: C20H26O2
MOLECULAR WEIGHT: 298.41924
SMILES: CC1=C(C(CCC1)(C)C)C#C/C(=C/C=C/C(=C/C(=O)O)/C)/C
Structure:

CAS RN: 76689-93-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C35H46O10
MOLECULAR WEIGHT: 626.73374
SMILES: C/C=C(\C)/C(=O)O[C@@H]1[C@H]2[C@H]3[C@](CO2)(C(CC([C@@]3(C4[C@@]1(C5=C([C@@H](CC5OC(C4)O)C6=CC=CO6)C)C)C)OC(=O)C)OC(=O)C)C
Structure:

CAS RN: 76343-70-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H40O7
MOLECULAR WEIGHT: 500.6237
SMILES: C/C=C(\C)/C(=O)O[C@@H]1[C@H]([C@@]2([C@@H]3C=C(C(=O)[C@H]3CC(=C[C@H]2C4C1(C4(C)C)O)COC(=O)C(C)C)C)O)C
Structure:

CAS RN: 75235-86-8
CAS Name: (E)-3-phenyl-2-propenoic acid [3,4,5-trihydroxy-6-[[5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-2-oxanyl]methyl ester
OPENEYE Name: [3,4,5-trihydroxy-6-[[5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]tetrahydropyran-2-yl]methyl (E)-3-phenylprop-2-enoate
IUPAC Name: [3,4,5-trihydroxy-6-[[5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate
SYSTEMATIC NAME: [6-[[7-(hydroxymethyl)-5-oxidanyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-3,4,5-tris(oxidanyl)oxan-2-yl]methyl (E)-3-phenylprop-2-enoate
MOLECULAR FORMULA: C24H28O10
MOLECULAR WEIGHT: 476.47312
SMILES: C1=CC=C(C=C1)/C=C/C(=O)OCC2C(C(C(C(O2)OC3C4C(C=CO3)C(C=C4CO)O)O)O)O
Structure:

CAS RN: 75207-13-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H18O6
MOLECULAR WEIGHT: 330.33192
SMILES: C[C@@H]1C[C@@H]2[C@H](O2)/C=C\C=C\C(=O)CC3=CC(=CC(=C3C(=O)O1)O)O
Structure:

CAS RN: 75144-71-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H34O9
MOLECULAR WEIGHT: 478.53206
SMILES: C/C=C(\C)/C(=O)O[C@@H]1[C@H]2C(=C[C@@H]([C@H]([C@@]2([C@@H]3[C@@]45[C@@H]1OC(=O)C[C@H]4[C@H]([C@H]([C@@]3(OC5)O)O)C)C)O)O)C
Structure:

CAS RN: 74217-57-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H25NO5
MOLECULAR WEIGHT: 335.3948
SMILES: C[C@@H]1C/C(=C/C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]1(C)O)/C
Structure:

CAS RN: 74799-14-7
CAS Name: (Z)-2-methyl-2-butenoic acid [(4aR,5R,6S,9aR)-3,4a,5-trimethyl-2-oxo-4,5,6,7,8,9a-hexahydrobenzo[f]benzofuran-6-yl] ester
OPENEYE Name: [(4aR,5R,6S,9aR)-3,4a,5-trimethyl-2-oxo-4,5,6,7,8,9a-hexahydrobenzo[f]benzofuran-6-yl] (Z)-2-methylbut-2-enoate
IUPAC Name: [(4aR,5R,6S,9aR)-3,4a,5-trimethyl-2-oxo-4,5,6,7,8,9a-hexahydrobenzo[f][1]benzofuran-6-yl] (Z)-2-methylbut-2-enoate
SYSTEMATIC NAME: [(4aR,5R,6S,9aR)-3,4a,5-trimethyl-2-oxidanylidene-4,5,6,7,8,9a-hexahydrobenzo[f][1]benzofuran-6-yl] (Z)-2-methylbut-2-enoate
MOLECULAR FORMULA: C20H26O4
MOLECULAR WEIGHT: 330.41804
SMILES: C/C=C(/C)\C(=O)O[C@H]1CCC2=C[C@@H]3C(=C(C(=O)O3)C)C[C@@]2([C@H]1C)C
Structure:

CAS RN: 76703-65-6
CAS Name: (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(R)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(R)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@@H]([C@@H]1C(=O)O[C@@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

CAS RN: 68085-85-8
CAS Name: (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@@H]([C@@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

CAS RN: 76703-64-5
CAS Name: (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@@H]([C@@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

CAS RN: 68085-85-8
CAS Name: (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(R)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@H]([C@H]1C(=O)O[C@@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

CAS RN: 76703-63-4
CAS Name: (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(R)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(R)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@H]([C@H]1C(=O)O[C@@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

CAS RN: 76703-62-3
CAS Name: (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester
OPENEYE Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C23H19ClF3NO3
MOLECULAR WEIGHT: 449.85007
SMILES: CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(/C(F)(F)F)\Cl)C
Structure:

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