(4-phenylphenyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (4-phenylphenyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-phenylphenyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-cyano-4-(4-pentylcyclohexyl)-1-cyclohexanecarboxylic acid (4-phenylphenyl) ester IUPAC Name: (4-phenylphenyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)-4-cyano-cyclohexanecarboxylic acid (4-phenylphenyl) ester Formula: C31H39NO2 MolecularWeight: 457.64686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C31H39NO2/c1-2-3-5-8-24-11-15-28(16-12-24)31(23-32)21-19-27(20-22-31)30(33)34-29-17-13-26(14-18-29)25-9-6-4-7-10-25/h4,6-7,9-10,13-14,17-18,24,27-28H,2-3,5,8,11-12,15-16,19-22H2,1H3