2-[2-fluoranyl-4-[(E)-3-(4-methylsulfanylphenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[2-fluoranyl-4-[(E)-3-(4-methylsulfanylphenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[2-fluoro-4-[(E)-3-(4-methylsulfanylphenyl)-3-oxo-prop-1-enyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[2-fluoro-4-[(E)-3-[4-(methylthio)phenyl]-3-oxoprop-1-enyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[2-fluoro-4-[(E)-3-(4-methylsulfanylphenyl)-3-oxoprop-1-enyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[2-fluoro-4-[(E)-3-keto-3-[4-(methylthio)phenyl]prop-1-enyl]phenoxy]-2-methyl-propionic acid Formula: C20H19FO4S MolecularWeight: 374.425863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)SC)F

Isomeric SMILES

CC(C)(C(=O)O)OC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)SC)F

InChI

InChI=1S/C20H19FO4S/c1-20(2,19(23)24)25-18-11-5-13(12-16(18)21)4-10-17(22)14-6-8-15(26-3)9-7-14/h4-12H,1-3H3,(H,23,24)/b10-4+