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

Systemtic Name: N-[3-[(3-chloranyl-4-methoxy-phenyl)amino]quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-(3-chloro-4-methoxy-anilino)quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[3-(3-chloro-4-methoxyanilino)-2-quinoxalinyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-chloro-4-methoxyanilino)quinoxalin-2-yl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-(3-chloro-4-methoxy-anilino)quinoxalin-2-yl]-2-methyl-5-nitro-benzenesulfonamide Formula: C22H18ClN5O5S MolecularWeight: 499.92682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN5O5S/c1-13-7-9-15(28(29)30)12-20(13)34(31,32)27-22-21(25-17-5-3-4-6-18(17)26-22)24-14-8-10-19(33-2)16(23)11-14/h3-12H,1-2H3,(H,24,25)(H,26,27)