N-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[3-(3,4-dimethylanilino)-2-quinoxalinyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-(3,4-dimethylanilino)quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C)C

InChI

InChI=1S/C23H21N5O4S/c1-14-8-10-17(12-16(14)3)24-22-23(26-20-7-5-4-6-19(20)25-22)27-33(31,32)21-13-18(28(29)30)11-9-15(21)2/h4-13H,1-3H3,(H,24,25)(H,26,27)