[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2C

InChI

InChI=1S/C20H27N3O5/c1-3-10-21-20(27)22-17(24)13-28-19(26)15-8-11-23(12-9-15)18(25)16-7-5-4-6-14(16)2/h4-7,15H,3,8-13H2,1-2H3,(H2,21,22,24,27)