[(5E)-3-acetyloxy-5-[(2Z)-2-[1-[5,6-bis(fluoranyl)-6-methyl-heptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexyl] ethanoate

Systemtic Name: [(5E)-3-acetyloxy-5-[(2Z)-2-[1-[5,6-bis(fluoranyl)-6-methyl-heptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexyl] ethanoate Openeye Name: [(5E)-3-acetoxy-5-[(2Z)-2-[1-(4,5-difluoro-1,5-dimethyl-hexyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexyl] acetate CAS Name: acetic acid [(5E)-3-acetyloxy-5-[(2Z)-2-[1-(5,6-difluoro-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylenecyclohexyl] ester IUPAC Name: [(5E)-3-acetyloxy-5-[(2Z)-2-[1-(5,6-difluoro-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] acetate Traditional Name: acetic acid [(5E)-3-acetoxy-5-[(2Z)-2-[1-(4,5-difluoro-1,5-dimethyl-hexyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexyl] ester Formula: C31H46F2O4 MolecularWeight: 520.691346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(C)(C)F)F)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)OC(=O)C)OC(=O)C)C

Isomeric SMILES

CC(CCC(C(C)(C)F)F)C1CCC\2C1(CCC/C2=C/C=C/3\CC(CC(C3=C)OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C31H46F2O4/c1-19(10-15-29(32)30(5,6)33)26-13-14-27-23(9-8-16-31(26,27)7)11-12-24-17-25(36-21(3)34)18-28(20(24)2)37-22(4)35/h11-12,19,25-29H,2,8-10,13-18H2,1,3-7H3/b23-11-,24-12+