2-[2-(2-methylsulfanylphenyl)carbonyl-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[2-(2-methylsulfanylphenyl)carbonyl-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[2-(2-methylsulfanylbenzoyl)benzofuran-5-yl]acetic acid CAS Name: 2-[2-[[2-(methylthio)phenyl]-oxomethyl]-5-benzofuranyl]acetic acid IUPAC Name: 2-[2-(2-methylsulfanylbenzoyl)-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[2-[2-(methylthio)benzoyl]benzofuran-5-yl]acetic acid Formula: C18H14O4S MolecularWeight: 326.36636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2=CC3=C(O2)C=CC(=C3)CC(=O)O

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2=CC3=C(O2)C=CC(=C3)CC(=O)O

InChI

InChI=1S/C18H14O4S/c1-23-16-5-3-2-4-13(16)18(21)15-10-12-8-11(9-17(19)20)6-7-14(12)22-15/h2-8,10H,9H2,1H3,(H,19,20)