(4-chloranyl-3-methyl-phenyl) 4-ethanoylbenzenesulfonate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 4-ethanoylbenzenesulfonate Openeye Name: (4-chloro-3-methyl-phenyl) 4-acetylbenzenesulfonate CAS Name: 4-acetylbenzenesulfonic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 4-acetylbenzenesulfonate Traditional Name: 4-acetylbenzenesulfonic acid (4-chloro-3-methyl-phenyl) ester Formula: C15H13ClO4S MolecularWeight: 324.77932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClO4S/c1-10-9-13(5-8-15(10)16)20-21(18,19)14-6-3-12(4-7-14)11(2)17/h3-9H,1-2H3