2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]acetic acid CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]acetic acid IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]acetic acid Formula: C10H11FO3S MolecularWeight: 230.255943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)O)F

InChI

InChI=1S/C10H11FO3S/c1-14-9-3-2-7(4-8(9)11)5-15-6-10(12)13/h2-4H,5-6H2,1H3,(H,12,13)