N-[3-[[3-(dimethylamino)phenyl]amino]quinoxalin-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-[[3-(dimethylamino)phenyl]amino]quinoxalin-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-[3-(dimethylamino)anilino]quinoxalin-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[3-[3-(dimethylamino)anilino]-2-quinoxalinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-[3-(dimethylamino)anilino]quinoxalin-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-[3-(dimethylamino)anilino]quinoxalin-2-yl]-4-nitro-benzenesulfonamide Formula: C22H20N6O4S MolecularWeight: 464.497

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4S/c1-27(2)17-7-5-6-15(14-17)23-21-22(25-20-9-4-3-8-19(20)24-21)26-33(31,32)18-12-10-16(11-13-18)28(29)30/h3-14H,1-2H3,(H,23,24)(H,25,26)