methyl 3-(4-fluorophenyl)-4-(2-methylsulfanylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 3-(4-fluorophenyl)-4-(2-methylsulfanylphenyl)-4-oxidanylidene-butanoate Openeye Name: methyl 3-(4-fluorophenyl)-4-(2-methylsulfanylphenyl)-4-oxo-butanoate CAS Name: 3-(4-fluorophenyl)-4-[2-(methylthio)phenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-4-(2-methylsulfanylphenyl)-4-oxobutanoate Traditional Name: 3-(4-fluorophenyl)-4-keto-4-[2-(methylthio)phenyl]butyric acid methyl ester Formula: C18H17FO3S MolecularWeight: 332.389183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)F)C(=O)C2=CC=CC=C2SC

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)F)C(=O)C2=CC=CC=C2SC

InChI

InChI=1S/C18H17FO3S/c1-22-17(20)11-15(12-7-9-13(19)10-8-12)18(21)14-5-3-4-6-16(14)23-2/h3-10,15H,11H2,1-2H3