N-[3-[(4-chloranyl-3-nitro-phenyl)amino]quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-chloranyl-3-nitro-phenyl)amino]quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[3-(4-chloro-3-nitro-anilino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[3-(4-chloro-3-nitroanilino)-2-quinoxalinyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[3-(4-chloro-3-nitroanilino)quinoxalin-2-yl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[3-(4-chloro-3-nitro-anilino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Formula: C22H18ClN5O4S MolecularWeight: 483.92742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H18ClN5O4S/c1-13-7-8-14(2)20(11-13)33(31,32)27-22-21(25-17-5-3-4-6-18(17)26-22)24-15-9-10-16(23)19(12-15)28(29)30/h3-12H,1-2H3,(H,24,25)(H,26,27)