(4-chlorophenyl)methyl 4-[[(5-oxidanylpyridin-2-yl)carbonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 4-[[(5-oxidanylpyridin-2-yl)carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: (4-chlorophenyl)methyl 4-[[(5-hydroxypyridine-2-carbonyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(5-hydroxy-2-pyridinyl)-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 4-[[(5-hydroxypyridine-2-carbonyl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(5-hydroxypicolinoyl)amino]methyl]piperidine-1-carboxylic acid (4-chlorobenzyl) ester Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=NC=C(C=C2)O)C(=O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=NC=C(C=C2)O)C(=O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3O4/c21-16-3-1-15(2-4-16)13-28-20(27)24-9-7-14(8-10-24)11-23-19(26)18-6-5-17(25)12-22-18/h1-6,12,14,25H,7-11,13H2,(H,23,26)