(3-methylphenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (3-methylphenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: m-tolyl 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid m-tolyl ester Formula: C13H10BrClO3S MolecularWeight: 361.6387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrClO3S/c1-9-3-2-4-11(7-9)18-19(16,17)13-6-5-10(14)8-12(13)15/h2-8H,1H3