(E)-3-(3-fluoranyl-2-methoxy-phenyl)-2-sulfanyl-prop-2-enoic acid

Systemtic Name: (E)-3-(3-fluoranyl-2-methoxy-phenyl)-2-sulfanyl-prop-2-enoic acid Openeye Name: (E)-3-(3-fluoro-2-methoxy-phenyl)-2-sulfanyl-prop-2-enoic acid CAS Name: (E)-3-(3-fluoro-2-methoxyphenyl)-2-mercapto-2-propenoic acid IUPAC Name: (E)-3-(3-fluoro-2-methoxyphenyl)-2-sulfanylprop-2-enoic acid Traditional Name: (E)-3-(3-fluoro-2-methoxy-phenyl)-2-mercapto-acrylic acid Formula: C10H9FO3S MolecularWeight: 228.240063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1F)C=C(C(=O)O)S

Isomeric SMILES

COC1=C(C=CC=C1F)/C=C(\C(=O)O)/S

InChI

InChI=1S/C10H9FO3S/c1-14-9-6(3-2-4-7(9)11)5-8(15)10(12)13/h2-5,15H,1H3,(H,12,13)/b8-5+