4-[[[3-[(4-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[3-[(4-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]methyl]benzoic acid Openeye Name: 4-[[[3-[(4-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]methyl]benzoic acid CAS Name: 4-[[[3-[(4-chlorophenyl)sulfonylamino]-2-quinoxalinyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[3-[(4-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]methyl]benzoic acid Traditional Name: 4-[[[3-[(4-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]methyl]benzoic acid Formula: C22H17ClN4O4S MolecularWeight: 468.91278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)Cl)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=C(C=C3)Cl)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H17ClN4O4S/c23-16-9-11-17(12-10-16)32(30,31)27-21-20(25-18-3-1-2-4-19(18)26-21)24-13-14-5-7-15(8-6-14)22(28)29/h1-12H,13H2,(H,24,25)(H,26,27)(H,28,29)