[(2R)-2,3-dimethylbut-3-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-2,3-dimethylbut-3-enyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-2,3-dimethylbut-3-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-2,3-dimethylbut-3-enyl] ester IUPAC Name: [(2R)-2,3-dimethylbut-3-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-2,3-dimethylbut-3-enyl] ester Formula: C13H18O3S MolecularWeight: 254.34522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C(=C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C)C(=C)C

InChI

InChI=1S/C13H18O3S/c1-10(2)12(4)9-16-17(14,15)13-7-5-11(3)6-8-13/h5-8,12H,1,9H2,2-4H3/t12-/m0/s1