[(2S)-1-oxidanylidene-1-[[(1S)-1-phenylethyl]amino]propan-2-yl] 1-aminocarbonylpiperidine-4-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[(1S)-1-phenylethyl]amino]propan-2-yl] 1-aminocarbonylpiperidine-4-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 1-carbamoylpiperidine-4-carboxylate CAS Name: 1-carbamoyl-4-piperidinecarboxylic acid [(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl] 1-carbamoylpiperidine-4-carboxylate Traditional Name: 1-carbamoylisonipecotic acid [(1S)-2-keto-1-methyl-2-[[(1S)-1-phenylethyl]amino]ethyl] ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)[C@H](C)OC(=O)C2CCN(CC2)C(=O)N

InChI

InChI=1S/C18H25N3O4/c1-12(14-6-4-3-5-7-14)20-16(22)13(2)25-17(23)15-8-10-21(11-9-15)18(19)24/h3-7,12-13,15H,8-11H2,1-2H3,(H2,19,24)(H,20,22)/t12-,13-/m0/s1