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

Systemtic Name: 3-nitro-N-[3-[(4-phenylazanylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(4-anilinoanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(4-anilinoanilino)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-anilinoanilino)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(4-anilinoanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C26H20N6O4S MolecularWeight: 512.5398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H20N6O4S/c33-32(34)21-9-6-10-22(17-21)37(35,36)31-26-25(29-23-11-4-5-12-24(23)30-26)28-20-15-13-19(14-16-20)27-18-7-2-1-3-8-18/h1-17,27H,(H,28,29)(H,30,31)