methyl 4-bromanyl-2-(fluoranylmethyl)-5-sulfamoyl-benzoate

Systemtic Name: methyl 4-bromanyl-2-(fluoranylmethyl)-5-sulfamoyl-benzoate Openeye Name: methyl 4-bromo-2-(fluoromethyl)-5-sulfamoyl-benzoate CAS Name: 4-bromo-2-(fluoromethyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-(fluoromethyl)-5-sulfamoylbenzoate Traditional Name: 4-bromo-2-(fluoromethyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C9H9BrFNO4S MolecularWeight: 326.139463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1CF)Br)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1CF)Br)S(=O)(=O)N

InChI

InChI=1S/C9H9BrFNO4S/c1-16-9(13)6-3-8(17(12,14)15)7(10)2-5(6)4-11/h2-3H,4H2,1H3,(H2,12,14,15)