2-(1-methylpyridin-1-ium-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide

Systemtic Name: 2-(1-methylpyridin-1-ium-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide Openeye Name: 2-(1-methylpyridin-1-ium-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide CAS Name: 2-(1-methyl-2-pyridin-1-iumyl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide IUPAC Name: 2-(1-methylpyridin-1-ium-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide Traditional Name: 2-(1-methylpyridin-1-ium-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone iodide Formula: C15H13F3INO MolecularWeight: 407.1695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13F3NO.HI/c1-19-9-3-2-4-13(19)10-14(20)11-5-7-12(8-6-11)15(16,17)18;/h2-9H,10H2,1H3;1H/q+1;/p-1