2-[(2-methanoyl-1-benzofuran-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(2-methanoyl-1-benzofuran-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-(2-formylbenzofuran-3-yl)sulfanylacetic acid CAS Name: 2-[(2-formyl-3-benzofuranyl)thio]acetic acid IUPAC Name: 2-[(2-formyl-1-benzofuran-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(2-formylbenzofuran-3-yl)thio]acetic acid Formula: C11H8O4S MolecularWeight: 236.24382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C=O)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C=O)SCC(=O)O

InChI

InChI=1S/C11H8O4S/c12-5-9-11(16-6-10(13)14)7-3-1-2-4-8(7)15-9/h1-5H,6H2,(H,13,14)