[(2R,3S,5S)-2-(hydroxymethyl)-5-methoxy-oxolan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2R,3S,5S)-2-(hydroxymethyl)-5-methoxy-oxolan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(2R,3S,5S)-2-(hydroxymethyl)-5-methoxy-tetrahydrofuran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3S,5S)-2-(hydroxymethyl)-5-methoxy-3-oxolanyl] ester IUPAC Name: [(2R,3S,5S)-2-(hydroxymethyl)-5-methoxyoxolan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3S,5S)-5-methoxy-2-methylol-tetrahydrofuran-3-yl] ester Formula: C13H18O6S MolecularWeight: 302.34342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(OC2CO)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H18O6S/c1-9-3-5-10(6-4-9)20(15,16)19-11-7-13(17-2)18-12(11)8-14/h3-6,11-14H,7-8H2,1-2H3/t11-,12+,13-/m0/s1