(2-acetamidophenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (2-acetamidophenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (2-acetamidophenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (2-acetamidophenyl) ester Formula: C14H11BrClNO4S MolecularWeight: 404.66344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C14H11BrClNO4S/c1-9(18)17-12-4-2-3-5-13(12)21-22(19,20)14-7-6-10(15)8-11(14)16/h2-8H,1H3,(H,17,18)