(3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-dione

Systemtic Name: (3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-dione Openeye Name: (3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-dione CAS Name: (3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-dione IUPAC Name: (3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-dione Traditional Name: (3S)-3-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,3-dihydropyrrolo[1,2-a]quinazoline-2,5-quinone Formula: C19H15N4O2+ MolecularWeight: 331.348

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)C3C(=O)CN4C3=NC(=O)C5=CC=CC=C54

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)[C@H]3C(=O)CN4C3=NC(=O)C5=CC=CC=C54

InChI

InChI=1S/C19H14N4O2/c1-22-14-9-5-3-7-12(14)20-17(22)16-15(24)10-23-13-8-4-2-6-11(13)19(25)21-18(16)23/h2-9,16H,10H2,1H3/p+1/t16-/m1/s1