[(2S)-3,3-dimethoxy-2-methyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-3,3-dimethoxy-2-methyl-propyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-3,3-dimethoxy-2-methyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-3,3-dimethoxy-2-methylpropyl] ester IUPAC Name: [(2S)-3,3-dimethoxy-2-methylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-3,3-dimethoxy-2-methyl-propyl] ester Formula: C13H20O5S MolecularWeight: 288.3599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O5S/c1-10-5-7-12(8-6-10)19(14,15)18-9-11(2)13(16-3)17-4/h5-8,11,13H,9H2,1-4H3/t11-/m0/s1