[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (Z)-3-oxidanylidene-2-propyl-dec-7-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (Z)-3-oxidanylidene-2-propyl-dec-7-enoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (Z)-3-oxo-2-propyl-dec-7-enoate CAS Name: (Z)-3-oxo-2-propyl-7-decenoic 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] (Z)-3-oxo-2-propyldec-7-enoate Traditional Name: (Z)-3-keto-2-propyl-dec-7-enoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C29H44O3 MolecularWeight: 440.65786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H44O3/c1-6-8-9-10-14-18-26(30)24(15-7-2)28(31)32-27-21-22(3)19-20-25(27)29(4,5)23-16-12-11-13-17-23/h8-9,11-13,16-17,22,24-25,27H,6-7,10,14-15,18-21H2,1-5H3/b9-8-/t22-,24?,25-,27-/m1/s1