1-methyl-3-(2-octyl-1,2,3,4-tetrazol-5-yl)pyridin-1-ium iodide

Systemtic Name: 1-methyl-3-(2-octyl-1,2,3,4-tetrazol-5-yl)pyridin-1-ium iodide Openeye Name: 1-methyl-3-(2-octyltetrazol-5-yl)pyridin-1-ium iodide CAS Name: 1-methyl-3-(2-octyl-5-tetrazolyl)pyridin-1-ium iodide IUPAC Name: 1-methyl-3-(2-octyltetrazol-5-yl)pyridin-1-ium iodide Traditional Name: 1-methyl-3-(2-octyltetrazol-5-yl)pyridin-1-ium iodide Formula: C15H24IN5 MolecularWeight: 401.28903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1N=C(N=N1)C2=C[N+](=CC=C2)C.[I-]

Isomeric SMILES

CCCCCCCCN1N=C(N=N1)C2=C[N+](=CC=C2)C.[I-]

InChI

InChI=1S/C15H24N5.HI/c1-3-4-5-6-7-8-12-20-17-15(16-18-20)14-10-9-11-19(2)13-14;/h9-11,13H,3-8,12H2,1-2H3;1H/q+1;/p-1