ethyl 2-cyclopropylcarbonyl-3-(4-fluoranyl-3-methoxy-2-methylsulfanyl-phenyl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-cyclopropylcarbonyl-3-(4-fluoranyl-3-methoxy-2-methylsulfanyl-phenyl)-3-oxidanylidene-propanoate Openeye Name: ethyl 2-(cyclopropanecarbonyl)-3-(4-fluoro-3-methoxy-2-methylsulfanyl-phenyl)-3-oxo-propanoate CAS Name: 2-[cyclopropyl(oxo)methyl]-3-[4-fluoro-3-methoxy-2-(methylthio)phenyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-(cyclopropanecarbonyl)-3-(4-fluoro-3-methoxy-2-methylsulfanylphenyl)-3-oxopropanoate Traditional Name: 2-(cyclopropanecarbonyl)-3-[4-fluoro-3-methoxy-2-(methylthio)phenyl]-3-keto-propionic acid ethyl ester Formula: C17H19FO5S MolecularWeight: 354.393163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1CC1)C(=O)C2=C(C(=C(C=C2)F)OC)SC

Isomeric SMILES

CCOC(=O)C(C(=O)C1CC1)C(=O)C2=C(C(=C(C=C2)F)OC)SC

InChI

InChI=1S/C17H19FO5S/c1-4-23-17(21)12(13(19)9-5-6-9)14(20)10-7-8-11(18)15(22-2)16(10)24-3/h7-9,12H,4-6H2,1-3H3