[4-(4-heptylcyclohexyl)phenyl] 4-methylbenzoate

Systemtic Name: [4-(4-heptylcyclohexyl)phenyl] 4-methylbenzoate Openeye Name: [4-(4-heptylcyclohexyl)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-(4-heptylcyclohexyl)phenyl] ester IUPAC Name: [4-(4-heptylcyclohexyl)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(4-heptylcyclohexyl)phenyl] ester Formula: C27H36O2 MolecularWeight: 392.57354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36O2/c1-3-4-5-6-7-8-22-11-15-23(16-12-22)24-17-19-26(20-18-24)29-27(28)25-13-9-21(2)10-14-25/h9-10,13-14,17-20,22-23H,3-8,11-12,15-16H2,1-2H3