2-[7-(4-methylsulfanylphenyl)carbonyl-1-benzofuran-5-yl]propanoic acid

Systemtic Name: 2-[7-(4-methylsulfanylphenyl)carbonyl-1-benzofuran-5-yl]propanoic acid Openeye Name: 2-[7-(4-methylsulfanylbenzoyl)benzofuran-5-yl]propanoic acid CAS Name: 2-[7-[[4-(methylthio)phenyl]-oxomethyl]-5-benzofuranyl]propanoic acid IUPAC Name: 2-[7-(4-methylsulfanylbenzoyl)-1-benzofuran-5-yl]propanoic acid Traditional Name: 2-[7-[4-(methylthio)benzoyl]benzofuran-5-yl]propionic acid Formula: C19H16O4S MolecularWeight: 340.39294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C2C(=C1)C=CO2)C(=O)C3=CC=C(C=C3)SC)C(=O)O

Isomeric SMILES

CC(C1=CC(=C2C(=C1)C=CO2)C(=O)C3=CC=C(C=C3)SC)C(=O)O

InChI

InChI=1S/C19H16O4S/c1-11(19(21)22)14-9-13-7-8-23-18(13)16(10-14)17(20)12-3-5-15(24-2)6-4-12/h3-11H,1-2H3,(H,21,22)