4-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-2-one

Systemtic Name: 4-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-2-one Openeye Name: 4-[(1-benzyltetrazol-5-yl)methyl]piperazin-2-one CAS Name: 4-[[1-(phenylmethyl)-5-tetrazolyl]methyl]-2-piperazinone IUPAC Name: 4-[(1-benzyltetrazol-5-yl)methyl]piperazin-2-one Traditional Name: 4-[(1-benzyltetrazol-5-yl)methyl]piperazin-2-one Formula: C13H16N6O MolecularWeight: 272.30574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC2=NN=NN2CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC(=O)N1)CC2=NN=NN2CC3=CC=CC=C3

InChI

InChI=1S/C13H16N6O/c20-13-10-18(7-6-14-13)9-12-15-16-17-19(12)8-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,14,20)