(3-ethanoylphenyl) 2,3,5,6-tetramethylbenzenesulfonate

Systemtic Name: (3-ethanoylphenyl) 2,3,5,6-tetramethylbenzenesulfonate Openeye Name: (3-acetylphenyl) 2,3,5,6-tetramethylbenzenesulfonate CAS Name: 2,3,5,6-tetramethylbenzenesulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2,3,5,6-tetramethylbenzenesulfonate Traditional Name: 2,3,5,6-tetramethylbenzenesulfonic acid (3-acetylphenyl) ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=CC=CC(=C2)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=CC=CC(=C2)C(=O)C)C)C

InChI

InChI=1S/C18H20O4S/c1-11-9-12(2)14(4)18(13(11)3)23(20,21)22-17-8-6-7-16(10-17)15(5)19/h6-10H,1-5H3