[2-[2-(4-cyanophenyl)ethyl]phenyl] 4-nonylcyclohexane-1-carboxylate

Systemtic Name: [2-[2-(4-cyanophenyl)ethyl]phenyl] 4-nonylcyclohexane-1-carboxylate Openeye Name: [2-[2-(4-cyanophenyl)ethyl]phenyl] 4-nonylcyclohexanecarboxylate CAS Name: 4-nonyl-1-cyclohexanecarboxylic acid [2-[2-(4-cyanophenyl)ethyl]phenyl] ester IUPAC Name: [2-[2-(4-cyanophenyl)ethyl]phenyl] 4-nonylcyclohexane-1-carboxylate Traditional Name: 4-nonylcyclohexanecarboxylic acid [2-[2-(4-cyanophenyl)ethyl]phenyl] ester Formula: C31H41NO2 MolecularWeight: 459.66274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2CCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C31H41NO2/c1-2-3-4-5-6-7-8-11-25-19-22-29(23-20-25)31(33)34-30-13-10-9-12-28(30)21-18-26-14-16-27(24-32)17-15-26/h9-10,12-17,25,29H,2-8,11,18-23H2,1H3