(4-acetamidophenyl) 2-bromanyl-4,5-dimethoxy-benzenesulfonate

Systemtic Name: (4-acetamidophenyl) 2-bromanyl-4,5-dimethoxy-benzenesulfonate Openeye Name: (4-acetamidophenyl) 2-bromo-4,5-dimethoxy-benzenesulfonate CAS Name: 2-bromo-4,5-dimethoxybenzenesulfonic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-bromo-4,5-dimethoxybenzenesulfonate Traditional Name: 2-bromo-4,5-dimethoxy-benzenesulfonic acid (4-acetamidophenyl) ester Formula: C16H16BrNO6S MolecularWeight: 430.27034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrNO6S/c1-10(19)18-11-4-6-12(7-5-11)24-25(20,21)16-9-15(23-3)14(22-2)8-13(16)17/h4-9H,1-3H3,(H,18,19)