2-[7-(4-methylsulfinylphenyl)carbonyl-6-oxidanyl-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[7-(4-methylsulfinylphenyl)carbonyl-6-oxidanyl-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[6-hydroxy-7-(4-methylsulfinylbenzoyl)benzofuran-5-yl]acetic acid CAS Name: 2-[6-hydroxy-7-[(4-methylsulfinylphenyl)-oxomethyl]-5-benzofuranyl]acetic acid IUPAC Name: 2-[6-hydroxy-7-(4-methylsulfinylbenzoyl)-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[6-hydroxy-7-(4-methylsulfinylbenzoyl)benzofuran-5-yl]acetic acid Formula: C18H14O6S MolecularWeight: 358.36516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2O)CC(=O)O)C=CO3

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2O)CC(=O)O)C=CO3

InChI

InChI=1S/C18H14O6S/c1-25(23)13-4-2-10(3-5-13)16(21)15-17(22)12(9-14(19)20)8-11-6-7-24-18(11)15/h2-8,22H,9H2,1H3,(H,19,20)