3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxy-phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxy-phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxy-phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxyphenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxyphenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[5-[(3-carboxyphenyl)sulfamoyl]-2,4-dimethoxy-phenyl]sulfonylamino]benzoic acid Formula: C22H20N2O10S2 MolecularWeight: 536.5316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O)OC

InChI

InChI=1S/C22H20N2O10S2/c1-33-17-11-18(34-2)20(36(31,32)24-16-8-4-6-14(10-16)22(27)28)12-19(17)35(29,30)23-15-7-3-5-13(9-15)21(25)26/h3-12,23-24H,1-2H3,(H,25,26)(H,27,28)