methyl 2-[bis(fluoranyl)methyl]-5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzoate

Systemtic Name: methyl 2-[bis(fluoranyl)methyl]-5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzoate Openeye Name: methyl 2-(difluoromethyl)-5-methylsulfonyl-4-(4-oxo-1-pyridyl)benzoate CAS Name: 2-(difluoromethyl)-5-methylsulfonyl-4-(4-oxo-1-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 2-(difluoromethyl)-5-methylsulfonyl-4-(4-oxopyridin-1-yl)benzoate Traditional Name: 2-(difluoromethyl)-4-(4-keto-1-pyridyl)-5-mesyl-benzoic acid methyl ester Formula: C15H13F2NO5S MolecularWeight: 357.329226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1C(F)F)N2C=CC(=O)C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1C(F)F)N2C=CC(=O)C=C2)S(=O)(=O)C

InChI

InChI=1S/C15H13F2NO5S/c1-23-15(20)11-8-13(24(2,21)22)12(7-10(11)14(16)17)18-5-3-9(19)4-6-18/h3-8,14H,1-2H3