5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfo-phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfo-phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfo-phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfophenyl]sulfonylamino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfophenyl]sulfonylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[3-[(3,5-dicarboxyphenyl)sulfamoyl]-5-sulfo-phenyl]sulfonylamino]isophthalic acid Formula: C22H16N2O15S3 MolecularWeight: 644.56184

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)NS(=O)(=O)C2=CC(=CC(=C2)S(=O)(=O)O)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)NS(=O)(=O)C2=CC(=CC(=C2)S(=O)(=O)O)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C22H16N2O15S3/c25-19(26)10-1-11(20(27)28)4-14(3-10)23-40(33,34)16-7-17(9-18(8-16)42(37,38)39)41(35,36)24-15-5-12(21(29)30)2-13(6-15)22(31)32/h1-9,23-24H,(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,37,38,39)