1-(3-methyl-4-oxidanyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide

Systemtic Name: 1-(3-methyl-4-oxidanyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide Openeye Name: 1-(4-hydroxy-3-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide CAS Name: 1-(4-hydroxy-3-methylphenyl)-2-(1-pyridin-1-iumyl)ethanone iodide IUPAC Name: 1-(4-hydroxy-3-methylphenyl)-2-pyridin-1-ium-1-ylethanone iodide Traditional Name: 1-(4-hydroxy-3-methyl-phenyl)-2-pyridin-1-ium-1-yl-ethanone iodide Formula: C14H14INO2 MolecularWeight: 355.17093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO2.HI/c1-11-9-12(5-6-13(11)16)14(17)10-15-7-3-2-4-8-15;/h2-9H,10H2,1H3;1H