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

Systemtic Name: N-[3-(3-ethylimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(3-ethylimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(3-ethyl-1-imidazol-3-iumyl)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-ethylimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(3-ethylimidazol-3-ium-1-yl)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C19H17N6O4S+ MolecularWeight: 425.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N6O4S/c1-2-23-10-11-24(13-23)19-18(20-16-8-3-4-9-17(16)21-19)22-30(28,29)15-7-5-6-14(12-15)25(26)27/h3-13H,2H2,1H3,(H,20,22)/q+1