3-(1-methylpyridin-1-ium-2-yl)-7-oxidanyl-chromen-4-one iodide

Systemtic Name: 3-(1-methylpyridin-1-ium-2-yl)-7-oxidanyl-chromen-4-one iodide Openeye Name: 7-hydroxy-3-(1-methylpyridin-1-ium-2-yl)chromen-4-one iodide CAS Name: 7-hydroxy-3-(1-methyl-2-pyridin-1-iumyl)-1-benzopyran-4-one iodide IUPAC Name: 7-hydroxy-3-(1-methylpyridin-1-ium-2-yl)chromen-4-one iodide Traditional Name: 7-hydroxy-3-(1-methylpyridin-1-ium-2-yl)chromone iodide Formula: C15H12INO3 MolecularWeight: 381.16515

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O.[I-]

InChI

InChI=1S/C15H11NO3.HI/c1-16-7-3-2-4-13(16)12-9-19-14-8-10(17)5-6-11(14)15(12)18;/h2-9H,1H3;1H