(2-ethanoyl-5-methyl-phenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (2-ethanoyl-5-methyl-phenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (2-acetyl-5-methyl-phenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (2-acetyl-5-methylphenyl) ester IUPAC Name: (2-acetyl-5-methylphenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (2-acetyl-5-methyl-phenyl) ester Formula: C15H12BrClO4S MolecularWeight: 403.67538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrClO4S/c1-9-3-5-12(10(2)18)14(7-9)21-22(19,20)15-6-4-11(16)8-13(15)17/h3-8H,1-2H3