(2E)-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-3H-inden-1-one iodide

Systemtic Name: (2E)-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-3H-inden-1-one iodide Openeye Name: (2E)-2-[(1-methylpyridin-1-ium-2-yl)methylene]indan-1-one iodide CAS Name: (2E)-2-[(1-methyl-2-pyridin-1-iumyl)methylidene]-3H-inden-1-one iodide IUPAC Name: (2E)-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-3H-inden-1-one iodide Traditional Name: (2E)-2-[(1-methylpyridin-1-ium-2-yl)methylene]indan-1-one iodide Formula: C16H14INO MolecularWeight: 363.19293

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=C2CC3=CC=CC=C3C2=O.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1/C=C/2\CC3=CC=CC=C3C2=O.[I-]

InChI

InChI=1S/C16H14NO.HI/c1-17-9-5-4-7-14(17)11-13-10-12-6-2-3-8-15(12)16(13)18;/h2-9,11H,10H2,1H3;1H/q+1;/p-1/b13-11+;