(phenylmethyl) 4-[[(3-methyl-4-oxidanyl-phenyl)carbonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[(3-methyl-4-oxidanyl-phenyl)carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[(4-hydroxy-3-methyl-benzoyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(4-hydroxy-3-methylphenyl)-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[(4-hydroxy-3-methylbenzoyl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(4-hydroxy-3-methyl-benzoyl)amino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C22H26N2O4/c1-16-13-19(7-8-20(16)25)21(26)23-14-17-9-11-24(12-10-17)22(27)28-15-18-5-3-2-4-6-18/h2-8,13,17,25H,9-12,14-15H2,1H3,(H,23,26)