(1-cyclohexyl-2-methyl-1-oxidanylidene-propan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-cyclohexyl-2-methyl-1-oxidanylidene-propan-2-yl) 4-methylbenzenesulfonate Openeye Name: (2-cyclohexyl-1,1-dimethyl-2-oxo-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-cyclohexyl-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-cyclohexyl-2-methyl-1-oxopropan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-cyclohexyl-2-keto-1,1-dimethyl-ethyl) ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)(C)C(=O)C2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)(C)C(=O)C2CCCCC2

InChI

InChI=1S/C17H24O4S/c1-13-9-11-15(12-10-13)22(19,20)21-17(2,3)16(18)14-7-5-4-6-8-14/h9-12,14H,4-8H2,1-3H3