[4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] butanoate

Systemtic Name: [4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] butanoate Openeye Name: [4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] butanoate CAS Name: butanoic acid [4-[4-(4-heptyl-1-cyclohexenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] butanoate Traditional Name: butyric acid [4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] ester Formula: C29H38O2 MolecularWeight: 418.61082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCC

Isomeric SMILES

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCC

InChI

InChI=1S/C29H38O2/c1-3-5-6-7-8-10-23-11-13-24(14-12-23)25-15-17-26(18-16-25)27-19-21-28(22-20-27)31-29(30)9-4-2/h13,15-23H,3-12,14H2,1-2H3