[4,5-diacetyloxy-2-(methoxymethyl)-6-[(E)-3-phenylprop-2-enyl]sulfanyl-oxan-3-yl] ethanoate

Systemtic Name: [4,5-diacetyloxy-2-(methoxymethyl)-6-[(E)-3-phenylprop-2-enyl]sulfanyl-oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-[(E)-cinnamyl]sulfanyl-2-(methoxymethyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-2-(methoxymethyl)-6-[[(E)-3-phenylprop-2-enyl]thio]-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-2-(methoxymethyl)-6-[(E)-3-phenylprop-2-enyl]sulfanyloxan-3-yl] acetate Traditional Name: acetic acid [4,5-diacetoxy-6-[[(E)-cinnamyl]thio]-2-(methoxymethyl)tetrahydropyran-3-yl] ester Formula: C22H28O8S MolecularWeight: 452.51792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)SCC=CC2=CC=CC=C2)COC

Isomeric SMILES

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)SC/C=C/C2=CC=CC=C2)COC

InChI

InChI=1S/C22H28O8S/c1-14(23)27-19-18(13-26-4)30-22(21(29-16(3)25)20(19)28-15(2)24)31-12-8-11-17-9-6-5-7-10-17/h5-11,18-22H,12-13H2,1-4H3/b11-8+