phenyl 2-(1-methylpyridin-1-ium-4-yl)ethanoate iodide

Systemtic Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)ethanoate iodide Openeye Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)acetate iodide CAS Name: 2-(1-methyl-4-pyridin-1-iumyl)acetic acid phenyl ester iodide IUPAC Name: phenyl 2-(1-methylpyridin-1-ium-4-yl)acetate iodide Traditional Name: 2-(1-methylpyridin-1-ium-4-yl)acetic acid phenyl ester iodide Formula: C14H14INO2 MolecularWeight: 355.17093

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)CC(=O)OC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)CC(=O)OC2=CC=CC=C2.[I-]

InChI

InChI=1S/C14H14NO2.HI/c1-15-9-7-12(8-10-15)11-14(16)17-13-5-3-2-4-6-13;/h2-10H,11H2,1H3;1H/q+1;/p-1