[4-(4-hexylcyclohexyl)phenyl] 4-butylbenzoate

Systemtic Name: [4-(4-hexylcyclohexyl)phenyl] 4-butylbenzoate Openeye Name: [4-(4-hexylcyclohexyl)phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-(4-hexylcyclohexyl)phenyl] ester IUPAC Name: [4-(4-hexylcyclohexyl)phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-(4-hexylcyclohexyl)phenyl] ester Formula: C29H40O2 MolecularWeight: 420.6267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C29H40O2/c1-3-5-7-8-10-24-11-15-25(16-12-24)26-19-21-28(22-20-26)31-29(30)27-17-13-23(14-18-27)9-6-4-2/h13-14,17-22,24-25H,3-12,15-16H2,1-2H3