1-[5-methyl-2-(1-methylpyridin-1-ium-3-yl)-1H-imidazol-4-yl]ethanone iodide

Systemtic Name: 1-[5-methyl-2-(1-methylpyridin-1-ium-3-yl)-1H-imidazol-4-yl]ethanone iodide Openeye Name: 1-[5-methyl-2-(1-methylpyridin-1-ium-3-yl)-1H-imidazol-4-yl]ethanone iodide CAS Name: 1-[5-methyl-2-(1-methyl-3-pyridin-1-iumyl)-1H-imidazol-4-yl]ethanone iodide IUPAC Name: 1-[5-methyl-2-(1-methylpyridin-1-ium-3-yl)-1H-imidazol-4-yl]ethanone iodide Traditional Name: 1-[5-methyl-2-(1-methylpyridin-1-ium-3-yl)-1H-imidazol-4-yl]ethanone iodide Formula: C12H14IN3O MolecularWeight: 343.16353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)C2=C[N+](=CC=C2)C)C(=O)C.[I-]

Isomeric SMILES

CC1=C(N=C(N1)C2=C[N+](=CC=C2)C)C(=O)C.[I-]

InChI

InChI=1S/C12H13N3O.HI/c1-8-11(9(2)16)14-12(13-8)10-5-4-6-15(3)7-10;/h4-7H,1-3H3;1H