2-[6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone iodide

Systemtic Name: 2-[6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone iodide Openeye Name: 2-[6-[2-(4-methoxyphenyl)-2-oxo-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone iodide CAS Name: 2-[6-[2-(4-methoxyphenyl)-2-oxoethyl]-1-methyl-2-pyridin-1-iumyl]-1-phenylethanone iodide IUPAC Name: 2-[6-[2-(4-methoxyphenyl)-2-oxoethyl]-1-methylpyridin-1-ium-2-yl]-1-phenylethanone iodide Traditional Name: 2-[6-[2-keto-2-(4-methoxyphenyl)ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone iodide Formula: C23H22INO3 MolecularWeight: 487.33015

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC=C1CC(=O)C2=CC=C(C=C2)OC)CC(=O)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=C(C=CC=C1CC(=O)C2=CC=C(C=C2)OC)CC(=O)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C23H22NO3.HI/c1-24-19(15-22(25)17-7-4-3-5-8-17)9-6-10-20(24)16-23(26)18-11-13-21(27-2)14-12-18;/h3-14H,15-16H2,1-2H3;1H/q+1;/p-1