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

Systemtic Name: (4-methylphenyl)methyl 4-[[(5-oxidanylpyridin-2-yl)carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: p-tolylmethyl 4-[[(5-hydroxypyridine-2-carbonyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(5-hydroxy-2-pyridinyl)-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-[[(5-hydroxypyridine-2-carbonyl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(5-hydroxypicolinoyl)amino]methyl]piperidine-1-carboxylic acid (4-methylbenzyl) ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)N2CCC(CC2)CNC(=O)C3=NC=C(C=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)N2CCC(CC2)CNC(=O)C3=NC=C(C=C3)O

InChI

InChI=1S/C21H25N3O4/c1-15-2-4-17(5-3-15)14-28-21(27)24-10-8-16(9-11-24)12-23-20(26)19-7-6-18(25)13-22-19/h2-7,13,16,25H,8-12,14H2,1H3,(H,23,26)