[(3S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(3S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(3S,5S,6R)-5-benzyloxy-6-(benzyloxymethyl)tetrahydropyran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)-3-oxanyl] ester IUPAC Name: [(3S,5S,6R)-5-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3S,5S,6R)-5-benzoxy-6-(benzoxymethyl)tetrahydropyran-3-yl] ester Formula: C27H30O6S MolecularWeight: 482.5885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C(OC2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2C[C@@H]([C@H](OC2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H30O6S/c1-21-12-14-25(15-13-21)34(28,29)33-24-16-26(31-18-23-10-6-3-7-11-23)27(32-19-24)20-30-17-22-8-4-2-5-9-22/h2-15,24,26-27H,16-20H2,1H3/t24-,26-,27+/m0/s1