[4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexen-1-yl)benzoate

Systemtic Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexen-1-yl)benzoate Openeye Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexen-1-yl)benzoate CAS Name: 4-(4-heptyl-1-cyclohexenyl)benzoic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexen-1-yl)benzoate Traditional Name: 4-(4-heptylcyclohexen-1-yl)benzoic acid [4-(2-methylbutyl)phenyl] ester Formula: C31H42O2 MolecularWeight: 446.66398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C31H42O2/c1-4-6-7-8-9-10-25-11-15-27(16-12-25)28-17-19-29(20-18-28)31(32)33-30-21-13-26(14-22-30)23-24(3)5-2/h13-15,17-22,24-25H,4-12,16,23H2,1-3H3