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

Systemtic Name: 1-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-(pyridin-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(1-phenyltetrazol-5-yl)-4-(2-pyridylmethyl)piperazin-4-ium CAS Name: 1-(1-phenyl-5-tetrazolyl)-4-(2-pyridinylmethyl)piperazin-4-ium IUPAC Name: 1-(1-phenyltetrazol-5-yl)-4-(pyridin-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(1-phenyltetrazol-5-yl)-4-(2-pyridylmethyl)piperazin-4-ium Formula: C17H20N7+ MolecularWeight: 322.3876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H19N7/c1-2-7-16(8-3-1)24-17(19-20-21-24)23-12-10-22(11-13-23)14-15-6-4-5-9-18-15/h1-9H,10-14H2/p+1