(3,5-dimethoxyphenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (3,5-dimethoxyphenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (3,5-dimethoxyphenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (3,5-dimethoxyphenyl) ester IUPAC Name: (3,5-dimethoxyphenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (3,5-dimethoxyphenyl) ester Formula: C14H12BrClO5S MolecularWeight: 407.66408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)OC

InChI

InChI=1S/C14H12BrClO5S/c1-19-10-6-11(20-2)8-12(7-10)21-22(17,18)14-4-3-9(15)5-13(14)16/h3-8H,1-2H3