methyl 2-[(3-acetamido-4-fluoranyl-phenyl)sulfamoyl]-5-bromanyl-benzoate

Systemtic Name: methyl 2-[(3-acetamido-4-fluoranyl-phenyl)sulfamoyl]-5-bromanyl-benzoate Openeye Name: methyl 2-[(3-acetamido-4-fluoro-phenyl)sulfamoyl]-5-bromo-benzoate CAS Name: 2-[(3-acetamido-4-fluorophenyl)sulfamoyl]-5-bromobenzoic acid methyl ester IUPAC Name: methyl 2-[(3-acetamido-4-fluorophenyl)sulfamoyl]-5-bromobenzoate Traditional Name: 2-[(3-acetamido-4-fluoro-phenyl)sulfamoyl]-5-bromo-benzoic acid methyl ester Formula: C16H14BrFN2O5S MolecularWeight: 445.260163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)C(=O)OC)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)C(=O)OC)F

InChI

InChI=1S/C16H14BrFN2O5S/c1-9(21)19-14-8-11(4-5-13(14)18)20-26(23,24)15-6-3-10(17)7-12(15)16(22)25-2/h3-8,20H,1-2H3,(H,19,21)