(1-methylpyridin-1-ium-4-yl) benzoate iodide

Systemtic Name: (1-methylpyridin-1-ium-4-yl) benzoate iodide Openeye Name: (1-methylpyridin-1-ium-4-yl) benzoate iodide CAS Name: benzoic acid (1-methyl-4-pyridin-1-iumyl) ester iodide IUPAC Name: (1-methylpyridin-1-ium-4-yl) benzoate iodide Traditional Name: benzoic acid (1-methylpyridin-1-ium-4-yl) ester iodide Formula: C13H12INO2 MolecularWeight: 341.14435

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)OC(=O)C2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)OC(=O)C2=CC=CC=C2.[I-]

InChI

InChI=1S/C13H12NO2.HI/c1-14-9-7-12(8-10-14)16-13(15)11-5-3-2-4-6-11;/h2-10H,1H3;1H/q+1;/p-1