(3,5-dimethoxyphenyl) 4-bromanylbenzenesulfonate

Systemtic Name: (3,5-dimethoxyphenyl) 4-bromanylbenzenesulfonate Openeye Name: (3,5-dimethoxyphenyl) 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid (3,5-dimethoxyphenyl) ester IUPAC Name: (3,5-dimethoxyphenyl) 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid (3,5-dimethoxyphenyl) ester Formula: C14H13BrO5S MolecularWeight: 373.21902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrO5S/c1-18-11-7-12(19-2)9-13(8-11)20-21(16,17)14-5-3-10(15)4-6-14/h3-9H,1-2H3