[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E)-6-methyl-3-oxidanylidene-2-prop-2-enyl-oct-6-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E)-6-methyl-3-oxidanylidene-2-prop-2-enyl-oct-6-enoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (E)-2-allyl-6-methyl-3-oxo-oct-6-enoate CAS Name: (E)-6-methyl-3-oxo-2-prop-2-enyl-6-octenoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E)-6-methyl-3-oxo-2-prop-2-enyloct-6-enoate Traditional Name: (E)-2-allyl-3-keto-6-methyl-oct-6-enoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C28H40O3 MolecularWeight: 424.6154

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CCC(=O)C(CC=C)C(=O)OC1CC(CCC1C(C)(C)C2=CC=CC=C2)C

Isomeric SMILES

C/C=C(\C)/CCC(=O)C(CC=C)C(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)(C)C2=CC=CC=C2)C

InChI

InChI=1S/C28H40O3/c1-7-12-23(25(29)18-16-20(3)8-2)27(30)31-26-19-21(4)15-17-24(26)28(5,6)22-13-10-9-11-14-22/h7-11,13-14,21,23-24,26H,1,12,15-19H2,2-6H3/b20-8+/t21-,23?,24-,26-/m1/s1