[4-(4-propylcyclohexyl)phenyl] 4-heptylbenzoate

Systemtic Name: [4-(4-propylcyclohexyl)phenyl] 4-heptylbenzoate Openeye Name: [4-(4-propylcyclohexyl)phenyl] 4-heptylbenzoate CAS Name: 4-heptylbenzoic acid [4-(4-propylcyclohexyl)phenyl] ester IUPAC Name: [4-(4-propylcyclohexyl)phenyl] 4-heptylbenzoate Traditional Name: 4-heptylbenzoic acid [4-(4-propylcyclohexyl)phenyl] ester Formula: C29H40O2 MolecularWeight: 420.6267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3CCC(CC3)CCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3CCC(CC3)CCC

InChI

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