(3-methylphenyl) 4-bromanylbenzenesulfonate

Systemtic Name: (3-methylphenyl) 4-bromanylbenzenesulfonate Openeye Name: m-tolyl 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid m-tolyl ester Formula: C13H11BrO3S MolecularWeight: 327.19364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrO3S/c1-10-3-2-4-12(9-10)17-18(15,16)13-7-5-11(14)6-8-13/h2-9H,1H3