[(1S,2S)-3,3-dimethyl-2-oxidanyl-cyclobutyl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(1S,2S)-3,3-dimethyl-2-oxidanyl-cyclobutyl]methyl 4-methylbenzenesulfonate Openeye Name: [(1S,2S)-2-hydroxy-3,3-dimethyl-cyclobutyl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-hydroxy-3,3-dimethylcyclobutyl]methyl ester IUPAC Name: [(1S,2S)-2-hydroxy-3,3-dimethylcyclobutyl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-hydroxy-3,3-dimethyl-cyclobutyl]methyl ester Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC(C2O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2CC([C@H]2O)(C)C

InChI

InChI=1S/C14H20O4S/c1-10-4-6-12(7-5-10)19(16,17)18-9-11-8-14(2,3)13(11)15/h4-7,11,13,15H,8-9H2,1-3H3/t11-,13-/m0/s1