methyl 6-(3-chloranyl-4-fluoranyl-phenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-(3-chloranyl-4-fluoranyl-phenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-(3-chloro-4-fluoro-phenyl)-4-methylsulfanyl-2-oxo-pyran-3-carboxylate CAS Name: 6-(3-chloro-4-fluorophenyl)-4-(methylthio)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-(3-chloro-4-fluorophenyl)-4-methylsulfanyl-2-oxopyran-3-carboxylate Traditional Name: 6-(3-chloro-4-fluoro-phenyl)-2-keto-4-(methylthio)pyran-3-carboxylic acid methyl ester Formula: C14H10ClFO4S MolecularWeight: 328.743203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClFO4S/c1-19-13(17)12-11(21-2)6-10(20-14(12)18)7-3-4-9(16)8(15)5-7/h3-6H,1-2H3