N-[3-[(3-fluorophenyl)amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[(3-fluorophenyl)amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(3-fluoroanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(3-fluoroanilino)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-fluoroanilino)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(3-fluoroanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C20H14FN5O4S MolecularWeight: 439.419663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])NC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])NC4=CC(=CC=C4)F

InChI

InChI=1S/C20H14FN5O4S/c21-13-5-3-6-14(11-13)22-19-20(24-18-10-2-1-9-17(18)23-19)25-31(29,30)16-8-4-7-15(12-16)26(27)28/h1-12H,(H,22,23)(H,24,25)