[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-4-piperidinecarboxylic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Traditional Name: 1-pivaloylisonipecotic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O4/c1-14-10-15(2)12-17(11-14)22-18(24)13-27-19(25)16-6-8-23(9-7-16)20(26)21(3,4)5/h10-12,16H,6-9,13H2,1-5H3,(H,22,24)