[(E)-6-(2,2-dimethyl-6-methylidene-cyclohexyl)-4-methyl-4-oxidanyl-hex-2-enyl] benzoate

Systemtic Name: [(E)-6-(2,2-dimethyl-6-methylidene-cyclohexyl)-4-methyl-4-oxidanyl-hex-2-enyl] benzoate Openeye Name: [(E)-6-(2,2-dimethyl-6-methylene-cyclohexyl)-4-hydroxy-4-methyl-hex-2-enyl] benzoate CAS Name: benzoic acid [(E)-6-(2,2-dimethyl-6-methylenecyclohexyl)-4-hydroxy-4-methylhex-2-enyl] ester IUPAC Name: [(E)-6-(2,2-dimethyl-6-methylidenecyclohexyl)-4-hydroxy-4-methylhex-2-enyl] benzoate Traditional Name: benzoic acid [(E)-6-(2,2-dimethyl-6-methylene-cyclohexyl)-4-hydroxy-4-methyl-hex-2-enyl] ester Formula: C23H32O3 MolecularWeight: 356.49838

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(=C)C1CCC(C)(C=CCOC(=O)C2=CC=CC=C2)O)C

Isomeric SMILES

CC1(CCCC(=C)C1CCC(C)(/C=C/COC(=O)C2=CC=CC=C2)O)C

InChI

InChI=1S/C23H32O3/c1-18-10-8-14-22(2,3)20(18)13-16-23(4,25)15-9-17-26-21(24)19-11-6-5-7-12-19/h5-7,9,11-12,15,20,25H,1,8,10,13-14,16-17H2,2-4H3/b15-9+