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

Systemtic Name: 2-[[3-(2-methylsulfanylethyl)-2-(3-oxidanylpropyl)-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[2-(3-hydroxypropyl)-3-(2-methylsulfanylethyl)benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[2-(3-hydroxypropyl)-3-[2-(methylthio)ethyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[2-(3-hydroxypropyl)-3-(2-methylsulfanylethyl)-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[2-(3-hydroxypropyl)-3-[2-(methylthio)ethyl]benzofuran-7-yl]oxyacetic acid Formula: C16H20O5S MolecularWeight: 324.392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O5S/c1-22-9-7-11-12-4-2-5-14(20-10-15(18)19)16(12)21-13(11)6-3-8-17/h2,4-5,17H,3,6-10H2,1H3,(H,18,19)