2-[[2-(hydroxymethyl)-3-(2-methylsulfanylethyl)-1-benzofuran-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[2-(hydroxymethyl)-3-(2-methylsulfanylethyl)-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[2-(hydroxymethyl)-3-(2-methylsulfanylethyl)benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[2-(hydroxymethyl)-3-[2-(methylthio)ethyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[2-(hydroxymethyl)-3-(2-methylsulfanylethyl)-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[2-methylol-3-[2-(methylthio)ethyl]benzofuran-7-yl]oxyacetic acid Formula: C14H16O5S MolecularWeight: 296.33884

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1=C(OC2=C1C=CC=C2OCC(=O)O)CO

Isomeric SMILES

CSCCC1=C(OC2=C1C=CC=C2OCC(=O)O)CO

InChI

InChI=1S/C14H16O5S/c1-20-6-5-9-10-3-2-4-11(18-8-13(16)17)14(10)19-12(9)7-15/h2-4,15H,5-8H2,1H3,(H,16,17)