(4-acetamidophenyl) 4-bromanyl-3-methoxy-benzenesulfonate

Systemtic Name: (4-acetamidophenyl) 4-bromanyl-3-methoxy-benzenesulfonate Openeye Name: (4-acetamidophenyl) 4-bromo-3-methoxy-benzenesulfonate CAS Name: 4-bromo-3-methoxybenzenesulfonic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 4-bromo-3-methoxybenzenesulfonate Traditional Name: 4-bromo-3-methoxy-benzenesulfonic acid (4-acetamidophenyl) ester Formula: C15H14BrNO5S MolecularWeight: 400.24436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)Br)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)Br)OC

InChI

InChI=1S/C15H14BrNO5S/c1-10(18)17-11-3-5-12(6-4-11)22-23(19,20)13-7-8-14(16)15(9-13)21-2/h3-9H,1-2H3,(H,17,18)