[4-(phenylcarbonyl)phenyl] 2-bromanyl-4,5-dimethoxy-benzenesulfonate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 2-bromanyl-4,5-dimethoxy-benzenesulfonate Openeye Name: (4-benzoylphenyl) 2-bromo-4,5-dimethoxy-benzenesulfonate CAS Name: 2-bromo-4,5-dimethoxybenzenesulfonic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 2-bromo-4,5-dimethoxybenzenesulfonate Traditional Name: 2-bromo-4,5-dimethoxy-benzenesulfonic acid (4-benzoylphenyl) ester Formula: C21H17BrO6S MolecularWeight: 477.32508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17BrO6S/c1-26-18-12-17(22)20(13-19(18)27-2)29(24,25)28-16-10-8-15(9-11-16)21(23)14-6-4-3-5-7-14/h3-13H,1-2H3