[(2S,3S,4S,6R)-6-methoxy-2-methyl-4-phenylmethoxy-oxan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,3S,4S,6R)-6-methoxy-2-methyl-4-phenylmethoxy-oxan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(2S,3S,4S,6R)-4-benzyloxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3S,4S,6R)-6-methoxy-2-methyl-4-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4S,6R)-6-methoxy-2-methyl-4-phenylmethoxyoxan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3S,4S,6R)-4-benzoxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC)OCC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1[C@@H]([C@H](C[C@@H](O1)OC)OCC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H26O6S/c1-15-9-11-18(12-10-15)28(22,23)27-21-16(2)26-20(24-3)13-19(21)25-14-17-7-5-4-6-8-17/h4-12,16,19-21H,13-14H2,1-3H3/t16-,19-,20+,21-/m0/s1