[(2R,3R,5S,6R)-3,5,6-trimethyl-2-oxidanyl-oxan-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2R,3R,5S,6R)-3,5,6-trimethyl-2-oxidanyl-oxan-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2R,3R,5S,6R)-2-hydroxy-3,5,6-trimethyl-tetrahydropyran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3R,5S,6R)-2-hydroxy-3,5,6-trimethyl-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,5S,6R)-2-hydroxy-3,5,6-trimethyloxan-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3R,5S,6R)-2-hydroxy-3,5,6-trimethyl-tetrahydropyran-2-yl]methyl ester Formula: C16H24O5S MolecularWeight: 328.42376

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(OC1C)(COS(=O)(=O)C2=CC=C(C=C2)C)O)C

Isomeric SMILES

C[C@H]1C[C@H]([C@@](O[C@@H]1C)(COS(=O)(=O)C2=CC=C(C=C2)C)O)C

InChI

InChI=1S/C16H24O5S/c1-11-5-7-15(8-6-11)22(18,19)20-10-16(17)13(3)9-12(2)14(4)21-16/h5-8,12-14,17H,9-10H2,1-4H3/t12-,13+,14+,16-/m0/s1