N-[3-(3-ethylbenzimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(3-ethylbenzimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(3-ethylbenzimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(3-ethyl-1-benzimidazol-3-iumyl)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-ethylbenzimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(3-ethylbenzimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C23H19N6O4S+ MolecularWeight: 475.49976

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(C2=CC=CC=C21)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CC[N+]1=CN(C2=CC=CC=C21)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N6O4S/c1-2-27-15-28(21-13-6-5-12-20(21)27)23-22(24-18-10-3-4-11-19(18)25-23)26-34(32,33)17-9-7-8-16(14-17)29(30)31/h3-15H,2H2,1H3,(H,24,26)/q+1