[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: [(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate Openeye Name: [(1R)-2-methoxy-2-oxo-1-phenyl-ethyl] 1-(5-carbamoyl-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-carbamoyl-2-pyridinyl)-4-piperidinecarboxylic acid [(1R)-2-methoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-methoxy-2-oxo-1-phenylethyl] 1-(5-carbamoylpyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-carbamoyl-2-pyridyl)isonipecotic acid [(1R)-2-keto-2-methoxy-1-phenyl-ethyl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)OC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(=O)N

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)OC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H23N3O5/c1-28-21(27)18(14-5-3-2-4-6-14)29-20(26)15-9-11-24(12-10-15)17-8-7-16(13-23-17)19(22)25/h2-8,13,15,18H,9-12H2,1H3,(H2,22,25)/t18-/m1/s1