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

Systemtic Name: [(2S,4R,6S)-6-methyl-4-oxidanyl-oxan-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2S,4R,6S)-4-hydroxy-6-methyl-tetrahydropyran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,4R,6S)-4-hydroxy-6-methyl-2-oxanyl]methyl ester IUPAC Name: [(2S,4R,6S)-4-hydroxy-6-methyloxan-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,4R,6S)-4-hydroxy-6-methyl-tetrahydropyran-2-yl]methyl ester Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(O1)COS(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

C[C@H]1C[C@H](C[C@H](O1)COS(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C14H20O5S/c1-10-3-5-14(6-4-10)20(16,17)18-9-13-8-12(15)7-11(2)19-13/h3-6,11-13,15H,7-9H2,1-2H3/t11-,12+,13-/m0/s1