3-[4-(5-sulfamoylthiophen-2-yl)sulfonylphenyl]propanoic acid

Systemtic Name: 3-[4-(5-sulfamoylthiophen-2-yl)sulfonylphenyl]propanoic acid Openeye Name: 3-[4-[(5-sulfamoyl-2-thienyl)sulfonyl]phenyl]propanoic acid CAS Name: 3-[4-[(5-sulfamoyl-2-thiophenyl)sulfonyl]phenyl]propanoic acid IUPAC Name: 3-[4-(5-sulfamoylthiophen-2-yl)sulfonylphenyl]propanoic acid Traditional Name: 3-[4-[(5-sulfamoyl-2-thienyl)sulfonyl]phenyl]propionic acid Formula: C13H13NO6S3 MolecularWeight: 375.44042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N

InChI

InChI=1S/C13H13NO6S3/c14-23(19,20)13-8-7-12(21-13)22(17,18)10-4-1-9(2-5-10)3-6-11(15)16/h1-2,4-5,7-8H,3,6H2,(H,15,16)(H2,14,19,20)