(4-ethanoylphenyl) 2,5-dimethylbenzenesulfonate

Systemtic Name: (4-ethanoylphenyl) 2,5-dimethylbenzenesulfonate Openeye Name: (4-acetylphenyl) 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid (4-acetylphenyl) ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4S/c1-11-4-5-12(2)16(10-11)21(18,19)20-15-8-6-14(7-9-15)13(3)17/h4-10H,1-3H3