1-(phenylmethyl)-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-ium

Systemtic Name: 1-(phenylmethyl)-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-ium Openeye Name: 1-benzyl-4-(1-phenyltetrazol-5-yl)piperazin-1-ium CAS Name: 1-(phenylmethyl)-4-(1-phenyl-5-tetrazolyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-(1-phenyltetrazol-5-yl)piperazin-1-ium Traditional Name: 1-benzyl-4-(1-phenyltetrazol-5-yl)piperazin-1-ium Formula: C18H21N6+ MolecularWeight: 321.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H20N6/c1-3-7-16(8-4-1)15-22-11-13-23(14-12-22)18-19-20-21-24(18)17-9-5-2-6-10-17/h1-10H,11-15H2/p+1