(phenylmethyl) 4-[5-(2H-1,2,3,4-tetrazol-5-yl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[5-(2H-1,2,3,4-tetrazol-5-yl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[5-(2H-tetrazol-5-yl)-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-(2H-tetrazol-5-yl)-2-pyridinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[5-(2H-tetrazol-5-yl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(2H-tetrazol-5-yl)-2-pyridyl]piperazine-1-carboxylic acid benzyl ester Formula: C18H19N7O2 MolecularWeight: 365.38916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C3=NNN=N3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C3=NNN=N3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C18H19N7O2/c26-18(27-13-14-4-2-1-3-5-14)25-10-8-24(9-11-25)16-7-6-15(12-19-16)17-20-22-23-21-17/h1-7,12H,8-11,13H2,(H,20,21,22,23)