[4-(2-bromanylethanoyl)-2-(methylsulfonylamino)phenyl] benzoate

Systemtic Name: [4-(2-bromanylethanoyl)-2-(methylsulfonylamino)phenyl] benzoate Openeye Name: [4-(2-bromoacetyl)-2-(methanesulfonamido)phenyl] benzoate CAS Name: benzoic acid [4-(2-bromo-1-oxoethyl)-2-(methanesulfonamido)phenyl] ester IUPAC Name: [4-(2-bromoacetyl)-2-(methanesulfonamido)phenyl] benzoate Traditional Name: benzoic acid [4-(2-bromoacetyl)-2-(methanesulfonamido)phenyl] ester Formula: C16H14BrNO5S MolecularWeight: 412.25506

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=CC(=C1)C(=O)CBr)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)NC1=C(C=CC(=C1)C(=O)CBr)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14BrNO5S/c1-24(21,22)18-13-9-12(14(19)10-17)7-8-15(13)23-16(20)11-5-3-2-4-6-11/h2-9,18H,10H2,1H3