2-(4-methylsulfanylphenoxy)-3-(phenylsulfonylamino)propanoic acid

Systemtic Name: 2-(4-methylsulfanylphenoxy)-3-(phenylsulfonylamino)propanoic acid Openeye Name: 3-(benzenesulfonamido)-2-(4-methylsulfanylphenoxy)propanoic acid CAS Name: 3-(benzenesulfonamido)-2-[4-(methylthio)phenoxy]propanoic acid IUPAC Name: 3-(benzenesulfonamido)-2-(4-methylsulfanylphenoxy)propanoic acid Traditional Name: 3-(benzenesulfonamido)-2-[4-(methylthio)phenoxy]propionic acid Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC(CNS(=O)(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)OC(CNS(=O)(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO5S2/c1-23-13-9-7-12(8-10-13)22-15(16(18)19)11-17-24(20,21)14-5-3-2-4-6-14/h2-10,15,17H,11H2,1H3,(H,18,19)