[(3R,4R)-3,4-bis(phenylmethoxy)hex-5-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(3R,4R)-3,4-bis(phenylmethoxy)hex-5-enyl] 4-methylbenzenesulfonate Openeye Name: [(3R,4R)-3,4-dibenzyloxyhex-5-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R,4R)-3,4-bis(phenylmethoxy)hex-5-enyl] ester IUPAC Name: [(3R,4R)-3,4-bis(phenylmethoxy)hex-5-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R,4R)-3,4-dibenzoxyhex-5-enyl] ester Formula: C27H30O5S MolecularWeight: 466.5891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C(C=C)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC[C@H]([C@@H](C=C)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H30O5S/c1-3-26(30-20-23-10-6-4-7-11-23)27(31-21-24-12-8-5-9-13-24)18-19-32-33(28,29)25-16-14-22(2)15-17-25/h3-17,26-27H,1,18-21H2,2H3/t26-,27-/m1/s1