[3-(2-bromanylethanoylamino)phenyl] benzenesulfonate

Systemtic Name: [3-(2-bromanylethanoylamino)phenyl] benzenesulfonate Openeye Name: [3-[(2-bromoacetyl)amino]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[(2-bromo-1-oxoethyl)amino]phenyl] ester IUPAC Name: [3-[(2-bromoacetyl)amino]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-[(2-bromoacetyl)amino]phenyl] ester Formula: C14H12BrNO4S MolecularWeight: 370.21838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)NC(=O)CBr

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)NC(=O)CBr

InChI

InChI=1S/C14H12BrNO4S/c15-10-14(17)16-11-5-4-6-12(9-11)20-21(18,19)13-7-2-1-3-8-13/h1-9H,10H2,(H,16,17)