methyl 9-(3,4,5-triacetyloxyoxan-2-yl)sulfanylnonanoate

Systemtic Name: methyl 9-(3,4,5-triacetyloxyoxan-2-yl)sulfanylnonanoate Openeye Name: methyl 9-(3,4,5-triacetoxytetrahydropyran-2-yl)sulfanylnonanoate CAS Name: 9-[(3,4,5-triacetyloxy-2-oxanyl)thio]nonanoic acid methyl ester IUPAC Name: methyl 9-(3,4,5-triacetyloxyoxan-2-yl)sulfanylnonanoate Traditional Name: 9-[(3,4,5-triacetoxytetrahydropyran-2-yl)thio]pelargonic acid methyl ester Formula: C21H34O9S MolecularWeight: 462.55426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)SCCCCCCCCC(=O)OC

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)SCCCCCCCCC(=O)OC

InChI

InChI=1S/C21H34O9S/c1-14(22)28-17-13-27-21(20(30-16(3)24)19(17)29-15(2)23)31-12-10-8-6-5-7-9-11-18(25)26-4/h17,19-21H,5-13H2,1-4H3