4-methoxy-N-[3-(3-methylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[3-(3-methylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[3-(3-methylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-methoxy-N-[3-(3-methyl-1-imidazol-3-iumyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[3-(3-methylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-[3-(3-methylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C19H18N5O3S+ MolecularWeight: 396.44292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N5O3S/c1-23-11-12-24(13-23)19-18(20-16-5-3-4-6-17(16)21-19)22-28(25,26)15-9-7-14(27-2)8-10-15/h3-13H,1-2H3,(H,20,22)/q+1