3-(2-hydroxyethyloxy)-4-(2-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-(2-hydroxyethyloxy)-4-(2-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid Openeye Name: 3-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid CAS Name: 3-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)-5-[[4-(methylthio)phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid Traditional Name: 3-(2-hydroxyethoxy)-4-(2-methoxyphenoxy)-5-[[4-(methylthio)phenyl]sulfonylamino]benzoic acid Formula: C23H23NO8S2 MolecularWeight: 505.56062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(C=C(C=C2OCCO)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC=CC=C1OC2=C(C=C(C=C2OCCO)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C23H23NO8S2/c1-30-19-5-3-4-6-20(19)32-22-18(13-15(23(26)27)14-21(22)31-12-11-25)24-34(28,29)17-9-7-16(33-2)8-10-17/h3-10,13-14,24-25H,11-12H2,1-2H3,(H,26,27)