1-(2-methoxy-5-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide CAS Name: 1-(2-methoxy-5-methylphenyl)-2-(1-pyridin-1-iumyl)ethanone iodide IUPAC Name: 1-(2-methoxy-5-methylphenyl)-2-pyridin-1-ium-1-ylethanone iodide Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide Formula: C15H16INO2 MolecularWeight: 369.19751

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)C[N+]2=CC=CC=C2.[I-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)C[N+]2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H16NO2.HI/c1-12-6-7-15(18-2)13(10-12)14(17)11-16-8-4-3-5-9-16;/h3-10H,11H2,1-2H3;1H/q+1;/p-1