1-(furan-2-yl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)methanimine iodide

Systemtic Name: 1-(furan-2-yl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)methanimine iodide Openeye Name: 1-(2-furyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)methanimine iodide CAS Name: 1-(2-furanyl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)methanimine iodide IUPAC Name: 1-(furan-2-yl)-N-(1-methyl-1,2,4-triazol-4-ium-4-yl)methanimine iodide Traditional Name: (E)-2-furfurylidene-(1-methyl-1,2,4-triazol-4-ium-4-yl)amine iodide Formula: C8H9IN4O MolecularWeight: 304.08773

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C=N1)N=CC2=CC=CO2.[I-]

Isomeric SMILES

CN1C=[N+](C=N1)/N=C/C2=CC=CO2.[I-]

InChI

InChI=1S/C8H9N4O.HI/c1-11-7-12(6-10-11)9-5-8-3-2-4-13-8;/h2-7H,1H3;1H/q+1;/p-1/b9-5+;