12-pyridin-1-ium-3-yl-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one

Systemtic Name: 12-pyridin-1-ium-3-yl-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one Openeye Name: 12-pyridin-1-ium-3-yl-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one CAS Name: 12-(3-pyridin-1-iumyl)-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one IUPAC Name: 12-pyridin-1-ium-3-yl-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one Traditional Name: 12-pyridin-1-ium-3-yl-2,3,5,6,12,12a-hexahydrobenzimidazolo[2,1-b]quinazolin-11-ium-1-one Formula: C19H18N4O+2 MolecularWeight: 318.37242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2C([N+]3=C(NC2=C1)NC4=CC=CC=C43)C5=C[NH+]=CC=C5

Isomeric SMILES

C1CC(=O)C2C([N+]3=C(NC2=C1)NC4=CC=CC=C43)C5=C[NH+]=CC=C5

InChI

InChI=1S/C19H16N4O/c24-16-9-3-7-14-17(16)18(12-5-4-10-20-11-12)23-15-8-2-1-6-13(15)21-19(23)22-14/h1-2,4-8,10-11,17-18H,3,9H2,(H,21,22)/p+2