(2-ethanoyl-5-methyl-phenyl) 3-bromanyl-5-chloranyl-2-methoxy-benzenesulfonate

Systemtic Name: (2-ethanoyl-5-methyl-phenyl) 3-bromanyl-5-chloranyl-2-methoxy-benzenesulfonate Openeye Name: (2-acetyl-5-methyl-phenyl) 3-bromo-5-chloro-2-methoxy-benzenesulfonate CAS Name: 3-bromo-5-chloro-2-methoxybenzenesulfonic acid (2-acetyl-5-methylphenyl) ester IUPAC Name: (2-acetyl-5-methylphenyl) 3-bromo-5-chloro-2-methoxybenzenesulfonate Traditional Name: 3-bromo-5-chloro-2-methoxy-benzenesulfonic acid (2-acetyl-5-methyl-phenyl) ester Formula: C16H14BrClO5S MolecularWeight: 433.70136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C)OS(=O)(=O)C2=CC(=CC(=C2OC)Br)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C)OS(=O)(=O)C2=CC(=CC(=C2OC)Br)Cl

InChI

InChI=1S/C16H14BrClO5S/c1-9-4-5-12(10(2)19)14(6-9)23-24(20,21)15-8-11(18)7-13(17)16(15)22-3/h4-8H,1-3H3