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

Systemtic Name: [2-cyano-4-(2-methylpropyl)phenyl] 4-(4-pentylcyclohexyl)benzoate Openeye Name: (2-cyano-4-isobutyl-phenyl) 4-(4-pentylcyclohexyl)benzoate CAS Name: 4-(4-pentylcyclohexyl)benzoic acid [2-cyano-4-(2-methylpropyl)phenyl] ester IUPAC Name: [2-cyano-4-(2-methylpropyl)phenyl] 4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)benzoic acid (2-cyano-4-isobutyl-phenyl) ester Formula: C29H37NO2 MolecularWeight: 431.60958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N

InChI

InChI=1S/C29H37NO2/c1-4-5-6-7-22-8-11-24(12-9-22)25-13-15-26(16-14-25)29(31)32-28-17-10-23(18-21(2)3)19-27(28)20-30/h10,13-17,19,21-22,24H,4-9,11-12,18H2,1-3H3