[2-cyano-4-(3-methylbutyl)phenyl] 4-(4-nonylcyclohexyl)benzoate

Systemtic Name: [2-cyano-4-(3-methylbutyl)phenyl] 4-(4-nonylcyclohexyl)benzoate Openeye Name: (2-cyano-4-isopentyl-phenyl) 4-(4-nonylcyclohexyl)benzoate CAS Name: 4-(4-nonylcyclohexyl)benzoic acid [2-cyano-4-(3-methylbutyl)phenyl] ester IUPAC Name: [2-cyano-4-(3-methylbutyl)phenyl] 4-(4-nonylcyclohexyl)benzoate Traditional Name: 4-(4-nonylcyclohexyl)benzoic acid (2-cyano-4-isoamyl-phenyl) ester Formula: C34H47NO2 MolecularWeight: 501.74248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCC(C)C)C#N

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCC(C)C)C#N

InChI

InChI=1S/C34H47NO2/c1-4-5-6-7-8-9-10-11-27-14-17-29(18-15-27)30-19-21-31(22-20-30)34(36)37-33-23-16-28(13-12-26(2)3)24-32(33)25-35/h16,19-24,26-27,29H,4-15,17-18H2,1-3H3