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

Systemtic Name: 3-(2-hydroxyethyloxy)-4-(3-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid Openeye Name: 3-(2-hydroxyethoxy)-4-(3-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid CAS Name: 3-(2-hydroxyethoxy)-4-(3-methoxyphenoxy)-5-[[4-(methylthio)phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-(2-hydroxyethoxy)-4-(3-methoxyphenoxy)-5-[(4-methylsulfanylphenyl)sulfonylamino]benzoic acid Traditional Name: 3-(2-hydroxyethoxy)-4-(3-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(=C1)OC2=C(C=C(C=C2OCCO)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC=CC(=C1)OC2=C(C=C(C=C2OCCO)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)SC

InChI

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