(1-oxidanylidene-1-phenyl-propan-2-yl) 2,4,6-trimethylbenzenesulfonate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 2,4,6-trimethylbenzenesulfonate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O4S/c1-12-10-13(2)18(14(3)11-12)23(20,21)22-15(4)17(19)16-8-6-5-7-9-16/h5-11,15H,1-4H3