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

Systemtic Name: 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Openeye Name: 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid CAS Name: 3-[[3-[(3-chlorophenyl)sulfonylamino]-2-quinoxalinyl]amino]benzoic acid IUPAC Name: 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Traditional Name: 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Formula: C21H15ClN4O4S MolecularWeight: 454.8862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H15ClN4O4S/c22-14-6-4-8-16(12-14)31(29,30)26-20-19(24-17-9-1-2-10-18(17)25-20)23-15-7-3-5-13(11-15)21(27)28/h1-12H,(H,23,24)(H,25,26)(H,27,28)