methyl 4-[2-[3,5-diacetyloxy-6-(acetyloxymethyl)-4-methyl-oxan-2-yl]sulfanylethylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-[3,5-diacetyloxy-6-(acetyloxymethyl)-4-methyl-oxan-2-yl]sulfanylethylamino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-[3,5-diacetoxy-6-(acetoxymethyl)-4-methyl-tetrahydropyran-2-yl]sulfanylethylamino]-4-oxo-butanoate CAS Name: 4-[2-[[3,5-diacetyloxy-6-(acetyloxymethyl)-4-methyl-2-oxanyl]thio]ethylamino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-[3,5-diacetyloxy-6-(acetyloxymethyl)-4-methyloxan-2-yl]sulfanylethylamino]-4-oxobutanoate Traditional Name: 4-[2-[[3,5-diacetoxy-6-(acetoxymethyl)-4-methyl-tetrahydropyran-2-yl]thio]ethylamino]-4-keto-butyric acid methyl ester Formula: C20H31NO10S MolecularWeight: 477.52584

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC(C1OC(=O)C)SCCNC(=O)CCC(=O)OC)COC(=O)C)OC(=O)C

Isomeric SMILES

CC1C(C(OC(C1OC(=O)C)SCCNC(=O)CCC(=O)OC)COC(=O)C)OC(=O)C

InChI

InChI=1S/C20H31NO10S/c1-11-18(29-13(3)23)15(10-28-12(2)22)31-20(19(11)30-14(4)24)32-9-8-21-16(25)6-7-17(26)27-5/h11,15,18-20H,6-10H2,1-5H3,(H,21,25)