(phenylmethyl) 4-[(1H-1,2,4-triazol-5-ylcarbonylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(1H-1,2,4-triazol-5-ylcarbonylamino)methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[(1H-1,2,4-triazole-5-carbonylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[[[oxo(1H-1,2,4-triazol-5-yl)methyl]amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(1H-1,2,4-triazole-5-carbonylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(1H-1,2,4-triazole-5-carbonylamino)methyl]piperidine-1-carboxylic acid benzyl ester Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=NC=NN2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=NC=NN2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H21N5O3/c23-16(15-19-12-20-21-15)18-10-13-6-8-22(9-7-13)17(24)25-11-14-4-2-1-3-5-14/h1-5,12-13H,6-11H2,(H,18,23)(H,19,20,21)