5-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-diazinan-2-one iodide

Systemtic Name: 5-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-diazinan-2-one iodide Openeye Name: 5-[(1-methylpyridin-1-ium-2-yl)methylene]hexahydropyrimidin-2-one iodide CAS Name: 5-[(1-methyl-2-pyridin-1-iumyl)methylidene]-1,3-diazinan-2-one iodide IUPAC Name: 5-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-diazinan-2-one iodide Traditional Name: 5-[(1-methylpyridin-1-ium-2-yl)methylene]hexahydropyrimidin-2-one iodide Formula: C11H14IN3O MolecularWeight: 331.15283

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=C2CNC(=O)NC2.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1C=C2CNC(=O)NC2.[I-]

InChI

InChI=1S/C11H13N3O.HI/c1-14-5-3-2-4-10(14)6-9-7-12-11(15)13-8-9;/h2-6H,7-8H2,1H3,(H-,12,13,15);1H