[2-cyano-4-(2-methylpropyl)phenyl] 4-(4-ethylcyclohexyl)benzoate

Systemtic Name: [2-cyano-4-(2-methylpropyl)phenyl] 4-(4-ethylcyclohexyl)benzoate Openeye Name: (2-cyano-4-isobutyl-phenyl) 4-(4-ethylcyclohexyl)benzoate CAS Name: 4-(4-ethylcyclohexyl)benzoic acid [2-cyano-4-(2-methylpropyl)phenyl] ester IUPAC Name: [2-cyano-4-(2-methylpropyl)phenyl] 4-(4-ethylcyclohexyl)benzoate Traditional Name: 4-(4-ethylcyclohexyl)benzoic acid (2-cyano-4-isobutyl-phenyl) ester Formula: C26H31NO2 MolecularWeight: 389.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N

Isomeric SMILES

CCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N

InChI

InChI=1S/C26H31NO2/c1-4-19-5-8-21(9-6-19)22-10-12-23(13-11-22)26(28)29-25-14-7-20(15-18(2)3)16-24(25)17-27/h7,10-14,16,18-19,21H,4-6,8-9,15H2,1-3H3