[1-oxidanylidene-1-(4-phenylbutan-2-ylamino)propan-2-yl] 1-aminocarbonylpiperidine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylbutan-2-ylamino)propan-2-yl] 1-aminocarbonylpiperidine-4-carboxylate Openeye Name: [1-methyl-2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethyl] 1-carbamoylpiperidine-4-carboxylate CAS Name: 1-carbamoyl-4-piperidinecarboxylic acid [1-oxo-1-(4-phenylbutan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylbutan-2-ylamino)propan-2-yl] 1-carbamoylpiperidine-4-carboxylate Traditional Name: 1-carbamoylisonipecotic acid [2-keto-1-methyl-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)OC(=O)C2CCN(CC2)C(=O)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C(C)OC(=O)C2CCN(CC2)C(=O)N

InChI

InChI=1S/C20H29N3O4/c1-14(8-9-16-6-4-3-5-7-16)22-18(24)15(2)27-19(25)17-10-12-23(13-11-17)20(21)26/h3-7,14-15,17H,8-13H2,1-2H3,(H2,21,26)(H,22,24)