[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C20H26N2O3 MolecularWeight: 342.43204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C20H26N2O3/c1-2-3-6-15-9-11-16(12-10-15)20(24)25-14-19(23)22-18-8-5-4-7-17(18)13-21/h4-5,7-8,15-16H,2-3,6,9-12,14H2,1H3,(H,22,23)