[(E,2R,3S)-2,6-bis(oxan-2-yloxy)-3-oxidanyl-hex-4-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E,2R,3S)-2,6-bis(oxan-2-yloxy)-3-oxidanyl-hex-4-enyl] 4-methylbenzenesulfonate Openeye Name: [(E,2R,3S)-3-hydroxy-2,6-di(tetrahydropyran-2-yloxy)hex-4-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E,2R,3S)-3-hydroxy-2,6-bis(2-oxanyloxy)hex-4-enyl] ester IUPAC Name: [(E,2R,3S)-3-hydroxy-2,6-bis(oxan-2-yloxy)hex-4-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E,2R,3S)-3-hydroxy-2,6-di(tetrahydropyran-2-yloxy)hex-4-enyl] ester Formula: C23H34O8S MolecularWeight: 470.57626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C=CCOC2CCCCO2)O)OC3CCCCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]([C@H](/C=C/COC2CCCCO2)O)OC3CCCCO3

InChI

InChI=1S/C23H34O8S/c1-18-10-12-19(13-11-18)32(25,26)30-17-21(31-23-9-3-5-15-29-23)20(24)7-6-16-28-22-8-2-4-14-27-22/h6-7,10-13,20-24H,2-5,8-9,14-17H2,1H3/b7-6+/t20-,21+,22?,23?/m0/s1