1-methyl-4-[2-(1,2,3,4-tetrazol-1-yl)phenyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[2-(1,2,3,4-tetrazol-1-yl)phenyl]piperazin-1-ium Openeye Name: 1-methyl-4-[2-(tetrazol-1-yl)phenyl]piperazin-1-ium CAS Name: 1-methyl-4-[2-(1-tetrazolyl)phenyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[2-(tetrazol-1-yl)phenyl]piperazin-1-ium Traditional Name: 1-methyl-4-[2-(tetrazol-1-yl)phenyl]piperazin-1-ium Formula: C12H17N6+ MolecularWeight: 245.30358

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2N3C=NN=N3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2N3C=NN=N3

InChI

InChI=1S/C12H16N6/c1-16-6-8-17(9-7-16)11-4-2-3-5-12(11)18-10-13-14-15-18/h2-5,10H,6-9H2,1H3/p+1