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

Systemtic Name: [4,5-diacetyloxy-2-methyl-6-[(E)-3-phenylprop-2-enyl]sulfanyl-oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-[(E)-cinnamyl]sulfanyl-2-methyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-2-methyl-6-[[(E)-3-phenylprop-2-enyl]thio]-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-2-methyl-6-[(E)-3-phenylprop-2-enyl]sulfanyloxan-3-yl] acetate Traditional Name: acetic acid [4,5-diacetoxy-6-[[(E)-cinnamyl]thio]-2-methyl-tetrahydropyran-3-yl] ester Formula: C21H26O7S MolecularWeight: 422.49194

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)SCC=CC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1C(C(C(C(O1)SC/C=C/C2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C21H26O7S/c1-13-18(26-14(2)22)19(27-15(3)23)20(28-16(4)24)21(25-13)29-12-8-11-17-9-6-5-7-10-17/h5-11,13,18-21H,12H2,1-4H3/b11-8+