(2,2,5,5-tetramethyl-6-oxidanylidene-cyclohexyl) 4-methylbenzenesulfonate

Systemtic Name: (2,2,5,5-tetramethyl-6-oxidanylidene-cyclohexyl) 4-methylbenzenesulfonate Openeye Name: (2,2,5,5-tetramethyl-6-oxo-cyclohexyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2,2,5,5-tetramethyl-6-oxocyclohexyl) ester IUPAC Name: (2,2,5,5-tetramethyl-6-oxocyclohexyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-keto-2,2,5,5-tetramethyl-cyclohexyl) ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(=O)C(CCC2(C)C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2C(=O)C(CCC2(C)C)(C)C

InChI

InChI=1S/C17H24O4S/c1-12-6-8-13(9-7-12)22(19,20)21-15-14(18)16(2,3)10-11-17(15,4)5/h6-9,15H,10-11H2,1-5H3