(4-tert-butylcyclohexyl) 4-[(2-methylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (4-tert-butylcyclohexyl) 4-[(2-methylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (4-tert-butylcyclohexyl) 4-(2-methylanilino)-4-oxo-butanoate CAS Name: 4-(2-methylanilino)-4-oxobutanoic acid (4-tert-butylcyclohexyl) ester IUPAC Name: (4-tert-butylcyclohexyl) 4-(2-methylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(o-toluidino)butyric acid (4-tert-butylcyclohexyl) ester Formula: C21H31NO3 MolecularWeight: 345.47574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCC(=O)OC2CCC(CC2)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCC(=O)OC2CCC(CC2)C(C)(C)C

InChI

InChI=1S/C21H31NO3/c1-15-7-5-6-8-18(15)22-19(23)13-14-20(24)25-17-11-9-16(10-12-17)21(2,3)4/h5-8,16-17H,9-14H2,1-4H3,(H,22,23)