[2-(4-cyanophenyl)phenyl] 4-(4-pentylcyclohexyl)benzoate

Systemtic Name: [2-(4-cyanophenyl)phenyl] 4-(4-pentylcyclohexyl)benzoate Openeye Name: [2-(4-cyanophenyl)phenyl] 4-(4-pentylcyclohexyl)benzoate CAS Name: 4-(4-pentylcyclohexyl)benzoic acid [2-(4-cyanophenyl)phenyl] ester IUPAC Name: [2-(4-cyanophenyl)phenyl] 4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)benzoic acid [2-(4-cyanophenyl)phenyl] ester Formula: C31H33NO2 MolecularWeight: 451.59922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C4=CC=C(C=C4)C#N

InChI

InChI=1S/C31H33NO2/c1-2-3-4-7-23-10-14-25(15-11-23)26-18-20-28(21-19-26)31(33)34-30-9-6-5-8-29(30)27-16-12-24(22-32)13-17-27/h5-6,8-9,12-13,16-21,23,25H,2-4,7,10-11,14-15H2,1H3