(3-ethanoylphenyl) 5-bromanyl-2-methyl-benzenesulfonate

Systemtic Name: (3-ethanoylphenyl) 5-bromanyl-2-methyl-benzenesulfonate Openeye Name: (3-acetylphenyl) 5-bromo-2-methyl-benzenesulfonate CAS Name: 5-bromo-2-methylbenzenesulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 5-bromo-2-methylbenzenesulfonate Traditional Name: 5-bromo-2-methyl-benzenesulfonic acid (3-acetylphenyl) ester Formula: C15H13BrO4S MolecularWeight: 369.23032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13BrO4S/c1-10-6-7-13(16)9-15(10)21(18,19)20-14-5-3-4-12(8-14)11(2)17/h3-9H,1-2H3