[(2S,3R,6S)-3-oxidanyl-2-propan-2-yloxy-3,6-dihydro-2H-pyran-6-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2S,3R,6S)-3-oxidanyl-2-propan-2-yloxy-3,6-dihydro-2H-pyran-6-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2S,3R,6S)-3-hydroxy-2-isopropoxy-3,6-dihydro-2H-pyran-6-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3R,6S)-3-hydroxy-2-propan-2-yloxy-3,6-dihydro-2H-pyran-6-yl]methyl ester IUPAC Name: [(2S,3R,6S)-3-hydroxy-2-propan-2-yloxy-3,6-dihydro-2H-pyran-6-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3R,6S)-3-hydroxy-2-isopropoxy-3,6-dihydro-2H-pyran-6-yl]methyl ester Formula: C16H22O6S MolecularWeight: 342.40728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C=CC(C(O2)OC(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2C=C[C@H]([C@H](O2)OC(C)C)O

InChI

InChI=1S/C16H22O6S/c1-11(2)21-16-15(17)9-6-13(22-16)10-20-23(18,19)14-7-4-12(3)5-8-14/h4-9,11,13,15-17H,10H2,1-3H3/t13-,15+,16-/m0/s1