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

Systemtic Name: (2-ethanoyl-5-methoxy-phenyl) 2-bromanyl-4-methyl-benzenesulfonate Openeye Name: (2-acetyl-5-methoxy-phenyl) 2-bromo-4-methyl-benzenesulfonate CAS Name: 2-bromo-4-methylbenzenesulfonic acid (2-acetyl-5-methoxyphenyl) ester IUPAC Name: (2-acetyl-5-methoxyphenyl) 2-bromo-4-methylbenzenesulfonate Traditional Name: 2-bromo-4-methyl-benzenesulfonic acid (2-acetyl-5-methoxy-phenyl) ester Formula: C16H15BrO5S MolecularWeight: 399.2563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)OC)C(=O)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)OC)C(=O)C)Br

InChI

InChI=1S/C16H15BrO5S/c1-10-4-7-16(14(17)8-10)23(19,20)22-15-9-12(21-3)5-6-13(15)11(2)18/h4-9H,1-3H3