4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[[3-(p-tolylsulfonylamino)quinoxalin-2-yl]amino]benzoic acid CAS Name: 2-hydroxy-4-[[3-[(4-methylphenyl)sulfonylamino]-2-quinoxalinyl]amino]benzoic acid IUPAC Name: 2-hydroxy-4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Traditional Name: 2-hydroxy-4-[[3-(tosylamino)quinoxalin-2-yl]amino]benzoic acid Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=C(C=C4)C(=O)O)O

InChI

InChI=1S/C22H18N4O5S/c1-13-6-9-15(10-7-13)32(30,31)26-21-20(24-17-4-2-3-5-18(17)25-21)23-14-8-11-16(22(28)29)19(27)12-14/h2-12,27H,1H3,(H,23,24)(H,25,26)(H,28,29)