[1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-ethanoylpiperidine-3-carboxylate

Systemtic Name: [1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-ethanoylpiperidine-3-carboxylate Openeye Name: [2-(2,4-dimethylanilino)-1-methyl-2-oxo-ethyl] 1-acetylpiperidine-3-carboxylate CAS Name: 1-acetyl-3-piperidinecarboxylic acid [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] 1-acetylpiperidine-3-carboxylate Traditional Name: 1-acetylnipecotic acid [2-(2,4-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)C2CCCN(C2)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)C2CCCN(C2)C(=O)C)C

InChI

InChI=1S/C19H26N2O4/c1-12-7-8-17(13(2)10-12)20-18(23)14(3)25-19(24)16-6-5-9-21(11-16)15(4)22/h7-8,10,14,16H,5-6,9,11H2,1-4H3,(H,20,23)