[4-[4-[4-(3-methylbutyl)cyclohexyl]phenyl]phenyl] pentanoate

Systemtic Name: [4-[4-[4-(3-methylbutyl)cyclohexyl]phenyl]phenyl] pentanoate Openeye Name: [4-[4-(4-isopentylcyclohexyl)phenyl]phenyl] pentanoate CAS Name: pentanoic acid [4-[4-[4-(3-methylbutyl)cyclohexyl]phenyl]phenyl] ester IUPAC Name: [4-[4-[4-(3-methylbutyl)cyclohexyl]phenyl]phenyl] pentanoate Traditional Name: valeric acid [4-[4-(4-isoamylcyclohexyl)phenyl]phenyl] ester Formula: C28H38O2 MolecularWeight: 406.60012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC(C)C

Isomeric SMILES

CCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC(C)C

InChI

InChI=1S/C28H38O2/c1-4-5-6-28(29)30-27-19-17-26(18-20-27)25-15-13-24(14-16-25)23-11-9-22(10-12-23)8-7-21(2)3/h13-23H,4-12H2,1-3H3