(4-cyanophenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (4-cyanophenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-cyanophenyl) 4-(4-methylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-methylcyclohexyl)-1-cyclohexanecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-methylcyclohexyl)cyclohexanecarboxylic acid (4-cyanophenyl) ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H27NO2/c1-15-2-6-17(7-3-15)18-8-10-19(11-9-18)21(23)24-20-12-4-16(14-22)5-13-20/h4-5,12-13,15,17-19H,2-3,6-11H2,1H3