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

Systemtic Name: (4-butylcyclohexyl) 4-butyl-4-cyano-cyclohexane-1-carboxylate Openeye Name: (4-butylcyclohexyl) 4-butyl-4-cyano-cyclohexanecarboxylate CAS Name: 4-butyl-4-cyano-1-cyclohexanecarboxylic acid (4-butylcyclohexyl) ester IUPAC Name: (4-butylcyclohexyl) 4-butyl-4-cyanocyclohexane-1-carboxylate Traditional Name: 4-butyl-4-cyano-cyclohexanecarboxylic acid (4-butylcyclohexyl) ester Formula: C22H37NO2 MolecularWeight: 347.53468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)OC(=O)C2CCC(CC2)(CCCC)C#N

Isomeric SMILES

CCCCC1CCC(CC1)OC(=O)C2CCC(CC2)(CCCC)C#N

InChI

InChI=1S/C22H37NO2/c1-3-5-7-18-8-10-20(11-9-18)25-21(24)19-12-15-22(17-23,16-13-19)14-6-4-2/h18-20H,3-16H2,1-2H3