1O1

5-(4-carboxyphenoxy)-2-{[(4-methylphenyl)sulfonyl]amino}benzoic acid


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Chemical Component Summary

Name5-(4-carboxyphenoxy)-2-{[(4-methylphenyl)sulfonyl]amino}benzoic acid
Identifiers5-(4-carboxyphenoxy)-2-[(4-methylphenyl)sulfonylamino]benzoic acid
FormulaC21 H17 N O7 S
Molecular Weight427.427
TypeNON-POLYMER
Isomeric SMILESCc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2C(=O)O)Oc3ccc(cc3)C(=O)O
InChIInChI=1S/C21H17NO7S/c1-13-2-9-17(10-3-13)30(27,28)22-19-11-8-16(12-18(19)21(25)26)29-15-6-4-14(5-7-15)20(23)24/h2-12,22H,1H3,(H,23,24)(H,25,26)
InChIKeyZZUNAJGLWXHEFZ-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count49
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 71819717
ChEMBL CHEMBL3092018