6-(1-methylpyridin-1-ium-4-yl)carbonyl-1,5-dihydrobenzimidazolo[1,2-b]isoquinolin-12-ium-11-one

Systemtic Name: 6-(1-methylpyridin-1-ium-4-yl)carbonyl-1,5-dihydrobenzimidazolo[1,2-b]isoquinolin-12-ium-11-one Openeye Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-1,5-dihydrobenzimidazolo[1,2-b]isoquinolin-12-ium-11-one CAS Name: 6-[(1-methyl-4-pyridin-1-iumyl)-oxomethyl]-1,5-dihydrobenzimidazolo[1,2-b]isoquinolin-12-ium-11-one IUPAC Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-1,5-dihydrobenzimidazolo[1,2-b]isoquinolin-12-ium-11-one Traditional Name: 6-(1-methylpyridin-1-ium-4-carbonyl)-1,5-dihydrobenzimidazol[1,2-b]isoquinolin-12-ium-11-one Formula: C22H17N3O2+2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)C2=C3NC4=CC=CCC4=[N+]3C(=O)C5=CC=CC=C52

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)C2=C3NC4=CC=CCC4=[N+]3C(=O)C5=CC=CC=C52

InChI

InChI=1S/C22H16N3O2/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/h2-8,10-13H,9H2,1H3/q+1/p+1