methyl 2-[bis(fluoranyl)methyl]-4-bromanyl-5-sulfamoyl-benzoate

Systemtic Name: methyl 2-[bis(fluoranyl)methyl]-4-bromanyl-5-sulfamoyl-benzoate Openeye Name: methyl 4-bromo-2-(difluoromethyl)-5-sulfamoyl-benzoate CAS Name: 4-bromo-2-(difluoromethyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-(difluoromethyl)-5-sulfamoylbenzoate Traditional Name: 4-bromo-2-(difluoromethyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C9H8BrF2NO4S MolecularWeight: 344.129926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1C(F)F)Br)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1C(F)F)Br)S(=O)(=O)N

InChI

InChI=1S/C9H8BrF2NO4S/c1-17-9(14)5-3-7(18(13,15)16)6(10)2-4(5)8(11)12/h2-3,8H,1H3,(H2,13,15,16)