[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C)C

InChI

InChI=1S/C24H28N2O4/c1-16-8-6-10-21(18(16)3)25-22(27)15-30-24(29)19-11-13-26(14-12-19)23(28)20-9-5-4-7-17(20)2/h4-10,19H,11-15H2,1-3H3,(H,25,27)