(E)-3-(7-methoxy-6-sulfanyl-1-benzofuran-5-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(7-methoxy-6-sulfanyl-1-benzofuran-5-yl)prop-2-enoic acid Openeye Name: (E)-3-(7-methoxy-6-sulfanyl-benzofuran-5-yl)prop-2-enoic acid CAS Name: (E)-3-(6-mercapto-7-methoxy-5-benzofuranyl)-2-propenoic acid IUPAC Name: (E)-3-(7-methoxy-6-sulfanyl-1-benzofuran-5-yl)prop-2-enoic acid Traditional Name: (E)-3-(6-mercapto-7-methoxy-benzofuran-5-yl)acrylic acid Formula: C12H10O4S MolecularWeight: 250.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1S)C=CC(=O)O)C=CO2

Isomeric SMILES

COC1=C2C(=CC(=C1S)/C=C/C(=O)O)C=CO2

InChI

InChI=1S/C12H10O4S/c1-15-11-10-7(4-5-16-10)6-8(12(11)17)2-3-9(13)14/h2-6,17H,1H3,(H,13,14)/b3-2+