phenyl 4-(4-butylcyclohexyl)-4-cyano-cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-(4-butylcyclohexyl)-4-cyano-cyclohexane-1-carboxylate Openeye Name: phenyl 4-(4-butylcyclohexyl)-4-cyano-cyclohexanecarboxylate CAS Name: 4-(4-butylcyclohexyl)-4-cyano-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(4-butylcyclohexyl)-4-cyanocyclohexane-1-carboxylate Traditional Name: 4-(4-butylcyclohexyl)-4-cyano-cyclohexanecarboxylic acid phenyl ester Formula: C24H33NO2 MolecularWeight: 367.52432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)C#N

InChI

InChI=1S/C24H33NO2/c1-2-3-7-19-10-12-21(13-11-19)24(18-25)16-14-20(15-17-24)23(26)27-22-8-5-4-6-9-22/h4-6,8-9,19-21H,2-3,7,10-17H2,1H3