[4-[4-(4-octylcyclohexen-1-yl)phenyl]phenyl] propanoate

Systemtic Name: [4-[4-(4-octylcyclohexen-1-yl)phenyl]phenyl] propanoate Openeye Name: [4-[4-(4-octylcyclohexen-1-yl)phenyl]phenyl] propanoate CAS Name: propanoic acid [4-[4-(4-octyl-1-cyclohexenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-octylcyclohexen-1-yl)phenyl]phenyl] propanoate Traditional Name: propionic acid [4-[4-(4-octylcyclohexen-1-yl)phenyl]phenyl] ester Formula: C29H38O2 MolecularWeight: 418.61082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CC

Isomeric SMILES

CCCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CC

InChI

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