[(E)-3,7-dimethyl-8-oxidanylidene-oct-6-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-3,7-dimethyl-8-oxidanylidene-oct-6-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-3,7-dimethyl-8-oxo-oct-6-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-3,7-dimethyl-8-oxooct-6-enyl] ester IUPAC Name: [(E)-3,7-dimethyl-8-oxooct-6-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-8-keto-3,7-dimethyl-oct-6-enyl] ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCC=C(C)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CC/C=C(\C)/C=O

InChI

InChI=1S/C17H24O4S/c1-14(5-4-6-16(3)13-18)11-12-21-22(19,20)17-9-7-15(2)8-10-17/h6-10,13-14H,4-5,11-12H2,1-3H3/b16-6+