3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[4-[4-[(3-carboxyphenyl)sulfamoyl]phenyl]phenyl]sulfonylamino]benzoic acid Formula: C26H20N2O8S2 MolecularWeight: 552.5756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C26H20N2O8S2/c29-25(30)19-3-1-5-21(15-19)27-37(33,34)23-11-7-17(8-12-23)18-9-13-24(14-10-18)38(35,36)28-22-6-2-4-20(16-22)26(31)32/h1-16,27-28H,(H,29,30)(H,31,32)