6-(1-methylpyridin-1-ium-4-yl)carbonyl-5H-benzimidazolo[1,2-b]isoquinolin-11-one iodide

Systemtic Name: 6-(1-methylpyridin-1-ium-4-yl)carbonyl-5H-benzimidazolo[1,2-b]isoquinolin-11-one iodide Openeye Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-5H-benzimidazolo[1,2-b]isoquinolin-11-one iodide CAS Name: 6-[(1-methyl-4-pyridin-1-iumyl)-oxomethyl]-5H-benzimidazolo[1,2-b]isoquinolin-11-one iodide IUPAC Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-5H-benzimidazolo[1,2-b]isoquinolin-11-one iodide Traditional Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-5H-benzimidazol[1,2-b]isoquinolin-11-one iodide Formula: C22H16IN3O2 MolecularWeight: 481.28581

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)C2=C3NC4=CC=CC=C4N3C(=O)C5=CC=CC=C52.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)C2=C3NC4=CC=CC=C4N3C(=O)C5=CC=CC=C52.[I-]

InChI

InChI=1S/C22H15N3O2.HI/c1-24-12-10-14(11-13-24)20(26)19-15-6-2-3-7-16(15)22(27)25-18-9-5-4-8-17(18)23-21(19)25;/h2-13H,1H3;1H