methyl 4-chloranyl-2-(fluoranylmethyl)-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-chloranyl-2-(fluoranylmethyl)-5-methylsulfonyl-benzoate Openeye Name: methyl 4-chloro-2-(fluoromethyl)-5-methylsulfonyl-benzoate CAS Name: 4-chloro-2-(fluoromethyl)-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-(fluoromethyl)-5-methylsulfonylbenzoate Traditional Name: 4-chloro-2-(fluoromethyl)-5-mesyl-benzoic acid methyl ester Formula: C10H10ClFO4S MolecularWeight: 280.700403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1CF)Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1CF)Cl)S(=O)(=O)C

InChI

InChI=1S/C10H10ClFO4S/c1-16-10(13)7-4-9(17(2,14)15)8(11)3-6(7)5-12/h3-4H,5H2,1-2H3