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

Systemtic Name: 1-methyl-3-(2-pentyl-1,2,3,4-tetrazol-5-yl)pyridin-1-ium iodide Openeye Name: 1-methyl-3-(2-pentyltetrazol-5-yl)pyridin-1-ium iodide CAS Name: 1-methyl-3-(2-pentyl-5-tetrazolyl)pyridin-1-ium iodide IUPAC Name: 1-methyl-3-(2-pentyltetrazol-5-yl)pyridin-1-ium iodide Traditional Name: 3-(2-amyltetrazol-5-yl)-1-methyl-pyridin-1-ium iodide Formula: C12H18IN5 MolecularWeight: 359.20929

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1N=C(N=N1)C2=C[N+](=CC=C2)C.[I-]

Isomeric SMILES

CCCCCN1N=C(N=N1)C2=C[N+](=CC=C2)C.[I-]

InChI

InChI=1S/C12H18N5.HI/c1-3-4-5-9-17-14-12(13-15-17)11-7-6-8-16(2)10-11;/h6-8,10H,3-5,9H2,1-2H3;1H/q+1;/p-1