(phenylmethyl) 4-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: benzyl 4-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-oxo-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-oxopiperazine-1-carboxylate Traditional Name: 3-keto-4-[(2-methyl-1,2,4-triazol-3-yl)methyl]piperazine-1-carboxylic acid benzyl ester Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)CN2CCN(CC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C(=NC=N1)CN2CCN(CC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O3/c1-19-14(17-12-18-19)9-20-7-8-21(10-15(20)22)16(23)24-11-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3