methyl 2-bromanyl-4-fluoranyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 2-bromanyl-4-fluoranyl-5-methylsulfonyl-benzoate Openeye Name: methyl 2-bromo-4-fluoro-5-methylsulfonyl-benzoate CAS Name: 2-bromo-4-fluoro-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-bromo-4-fluoro-5-methylsulfonylbenzoate Traditional Name: 2-bromo-4-fluoro-5-mesyl-benzoic acid methyl ester Formula: C9H8BrFO4S MolecularWeight: 311.124823

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1Br)F)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1Br)F)S(=O)(=O)C

InChI

InChI=1S/C9H8BrFO4S/c1-15-9(12)5-3-8(16(2,13)14)7(11)4-6(5)10/h3-4H,1-2H3