4-methyl-N-[3-(3-methylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-(3-methylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-(3-methylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-methyl-N-[3-(3-methyl-1-pyridin-1-iumyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-(3-methylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[3-(3-methylpyridin-1-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C21H19N4O2S+ MolecularWeight: 391.46616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2[N+]4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2[N+]4=CC=CC(=C4)C

InChI

InChI=1S/C21H19N4O2S/c1-15-9-11-17(12-10-15)28(26,27)24-20-21(25-13-5-6-16(2)14-25)23-19-8-4-3-7-18(19)22-20/h3-14H,1-2H3,(H,22,24)/q+1