[3,4,5-triacetyloxy-6-(4-acetyloxy-3-cyano-but-2-enoxy)oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(4-acetyloxy-3-cyano-but-2-enoxy)oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(4-acetoxy-3-cyano-but-2-enoxy)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-(4-acetyloxy-3-cyanobut-2-enoxy)-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(4-acetyloxy-3-cyanobut-2-enoxy)oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(4-acetoxy-3-cyano-but-2-enoxy)tetrahydropyran-2-yl]methyl ester Formula: C21H27NO12 MolecularWeight: 485.43858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OCC=C(COC(=O)C)C#N)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)OCC=C(COC(=O)C)C#N)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C21H27NO12/c1-11(23)29-9-16(8-22)6-7-28-21-20(33-15(5)27)19(32-14(4)26)18(31-13(3)25)17(34-21)10-30-12(2)24/h6,17-21H,7,9-10H2,1-5H3