methyl 2-[bis(fluoranyl)methyl]-4-methanoyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 2-[bis(fluoranyl)methyl]-4-methanoyl-5-methylsulfonyl-benzoate Openeye Name: methyl 2-(difluoromethyl)-4-formyl-5-methylsulfonyl-benzoate CAS Name: 2-(difluoromethyl)-4-formyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-(difluoromethyl)-4-formyl-5-methylsulfonylbenzoate Traditional Name: 2-(difluoromethyl)-4-formyl-5-mesyl-benzoic acid methyl ester Formula: C11H10F2O5S MolecularWeight: 292.255906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C(=C1)S(=O)(=O)C)C=O)C(F)F

Isomeric SMILES

COC(=O)C1=C(C=C(C(=C1)S(=O)(=O)C)C=O)C(F)F

InChI

InChI=1S/C11H10F2O5S/c1-18-11(15)8-4-9(19(2,16)17)6(5-14)3-7(8)10(12)13/h3-5,10H,1-2H3