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

Systemtic Name: N-[3-[(2,4-dimethoxyphenyl)amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(2,4-dimethoxyanilino)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(2,4-dimethoxyanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C22H19N5O6S MolecularWeight: 481.48116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H19N5O6S/c1-32-15-10-11-19(20(13-15)33-2)25-21-22(24-18-9-4-3-8-17(18)23-21)26-34(30,31)16-7-5-6-14(12-16)27(28)29/h3-13H,1-2H3,(H,23,25)(H,24,26)