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

Systemtic Name: 3-nitro-N-[3-[[3-(4-nitrophenyl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-nitro-N-[3-[3-(4-nitrophenyl)anilino]quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-nitro-N-[3-[3-(4-nitrophenyl)anilino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[3-[3-(4-nitrophenyl)anilino]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-nitro-N-[3-[3-(4-nitrophenyl)anilino]quinoxalin-2-yl]benzenesulfonamide Formula: C26H18N6O6S MolecularWeight: 542.52272

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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)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])NC4=CC=CC(=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H18N6O6S/c33-31(34)20-13-11-17(12-14-20)18-5-3-6-19(15-18)27-25-26(29-24-10-2-1-9-23(24)28-25)30-39(37,38)22-8-4-7-21(16-22)32(35)36/h1-16H,(H,27,28)(H,29,30)