[(2R,3S,6R)-3-acetyloxy-6-octylsulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,6R)-3-acetyloxy-6-octylsulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl ethanoate Openeye Name: [(2R,3S,6R)-3-acetoxy-6-octylsulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,6R)-3-acetyloxy-6-(octylthio)-3,6-dihydro-2H-pyran-2-yl]methyl ester IUPAC Name: [(2R,3S,6R)-3-acetyloxy-6-octylsulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,6R)-3-acetoxy-6-(octylthio)-3,6-dihydro-2H-pyran-2-yl]methyl ester Formula: C18H30O5S MolecularWeight: 358.4928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1C=CC(C(O1)COC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCS[C@@H]1C=C[C@@H]([C@H](O1)COC(=O)C)OC(=O)C

InChI

InChI=1S/C18H30O5S/c1-4-5-6-7-8-9-12-24-18-11-10-16(22-15(3)20)17(23-18)13-21-14(2)19/h10-11,16-18H,4-9,12-13H2,1-3H3/t16-,17+,18+/m0/s1