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

Systemtic Name: (3-methylphenyl) 3-bromanyl-4-methoxy-benzenesulfonate Openeye Name: m-tolyl 3-bromo-4-methoxy-benzenesulfonate CAS Name: 3-bromo-4-methoxybenzenesulfonic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 3-bromo-4-methoxybenzenesulfonate Traditional Name: 3-bromo-4-methoxy-benzenesulfonic acid m-tolyl ester Formula: C14H13BrO4S MolecularWeight: 357.21962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C14H13BrO4S/c1-10-4-3-5-11(8-10)19-20(16,17)12-6-7-14(18-2)13(15)9-12/h3-9H,1-2H3