4-fluoranyl-N-[3-(furan-2-ylmethylamino)quinoxalin-4-ium-2-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-(furan-2-ylmethylamino)quinoxalin-4-ium-2-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-(2-furylmethylamino)quinoxalin-4-ium-2-yl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-(2-furanylmethylamino)-2-quinoxalin-4-iumyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-(furan-2-ylmethylamino)quinoxalin-4-ium-2-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-(2-furfurylamino)quinoxalin-4-ium-2-yl]benzenesulfonamide Formula: C19H16FN4O3S+ MolecularWeight: 399.418743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH+]=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)F)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)[NH+]=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)F)NCC4=CC=CO4

InChI

InChI=1S/C19H15FN4O3S/c20-13-7-9-15(10-8-13)28(25,26)24-19-18(21-12-14-4-3-11-27-14)22-16-5-1-2-6-17(16)23-19/h1-11H,12H2,(H,21,22)(H,23,24)/p+1