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

Systemtic Name: (4-heptylcyclohexyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-heptylcyclohexyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-cyano-4-(4-pentylcyclohexyl)-1-cyclohexanecarboxylic acid (4-heptylcyclohexyl) ester IUPAC Name: (4-heptylcyclohexyl) 4-cyano-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)-4-cyano-cyclohexanecarboxylic acid (4-heptylcyclohexyl) ester Formula: C32H55NO2 MolecularWeight: 485.7846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)OC(=O)C2CCC(CC2)(C#N)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)OC(=O)C2CCC(CC2)(C#N)C3CCC(CC3)CCCCC

InChI

InChI=1S/C32H55NO2/c1-3-5-7-8-10-12-27-15-19-30(20-16-27)35-31(34)28-21-23-32(25-33,24-22-28)29-17-13-26(14-18-29)11-9-6-4-2/h26-30H,3-24H2,1-2H3