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

Systemtic Name: N-[3-(3-pentylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(3-pentylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(3-pentyl-1-imidazol-3-iumyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(3-pentylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-(3-amylimidazol-3-ium-1-yl)quinoxalin-2-yl]benzenesulfonamide Formula: C22H24N5O2S+ MolecularWeight: 422.52326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N5O2S/c1-2-3-9-14-26-15-16-27(17-26)22-21(23-19-12-7-8-13-20(19)24-22)25-30(28,29)18-10-5-4-6-11-18/h4-8,10-13,15-17H,2-3,9,14H2,1H3,(H,23,25)/q+1