3-methyl-6-sulfanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-methyl-6-sulfanyl-1-benzofuran-2-carboxylic acid Openeye Name: 3-methyl-6-sulfanyl-benzofuran-2-carboxylic acid CAS Name: 6-mercapto-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 3-methyl-6-sulfanyl-1-benzofuran-2-carboxylic acid Traditional Name: 6-mercapto-3-methyl-coumarilic acid Formula: C10H8O3S MolecularWeight: 208.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC(=C2)S)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=CC(=C2)S)C(=O)O

InChI

InChI=1S/C10H8O3S/c1-5-7-3-2-6(14)4-8(7)13-9(5)10(11)12/h2-4,14H,1H3,(H,11,12)