1-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-4-ium

Systemtic Name: 1-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-4-ium Openeye Name: 1-[[1-(p-tolyl)tetrazol-5-yl]methyl]piperazin-4-ium CAS Name: 1-[[1-(4-methylphenyl)-5-tetrazolyl]methyl]piperazin-4-ium IUPAC Name: 1-[[1-(4-methylphenyl)tetrazol-5-yl]methyl]piperazin-4-ium Traditional Name: 1-[[1-(p-tolyl)tetrazol-5-yl]methyl]piperazin-4-ium Formula: C13H19N6+ MolecularWeight: 259.33016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)CN3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)CN3CC[NH2+]CC3

InChI

InChI=1S/C13H18N6/c1-11-2-4-12(5-3-11)19-13(15-16-17-19)10-18-8-6-14-7-9-18/h2-5,14H,6-10H2,1H3/p+1