methyl (2R,4S,5R)-2,4-diacetyloxy-5-[4,4,5,5,6,6,6-heptakis(fluoranyl)hexanoylamino]-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate

Systemtic Name: methyl (2R,4S,5R)-2,4-diacetyloxy-5-[4,4,5,5,6,6,6-heptakis(fluoranyl)hexanoylamino]-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate Openeye Name: methyl (2R,4S,5R)-2,4-diacetoxy-5-(4,4,5,5,6,6,6-heptafluorohexanoylamino)-6-[(1R,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-carboxylate CAS Name: (2R,4S,5R)-2,4-diacetyloxy-5-[(4,4,5,5,6,6,6-heptafluoro-1-oxohexyl)amino]-6-[(1R,2R)-1,2,3-triacetyloxypropyl]-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S,5R)-2,4-diacetyloxy-5-(4,4,5,5,6,6,6-heptafluorohexanoylamino)-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate Traditional Name: (2R,4S,5R)-2,4-diacetoxy-5-(4,4,5,5,6,6,6-heptafluorohexanoylamino)-6-[(1R,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-carboxylic acid methyl ester Formula: C26H32F7NO14 MolecularWeight: 715.519402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C1C(C(CC(O1)(C(=O)OC)OC(=O)C)OC(=O)C)NC(=O)CCC(C(C(F)(F)F)(F)F)(F)F)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@H]([C@@H](C1[C@@H]([C@H](C[C@](O1)(C(=O)OC)OC(=O)C)OC(=O)C)NC(=O)CCC(C(C(F)(F)F)(F)F)(F)F)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H32F7NO14/c1-11(35)43-10-17(45-13(3)37)20(46-14(4)38)21-19(34-18(40)7-8-24(27,28)25(29,30)26(31,32)33)16(44-12(2)36)9-23(48-21,22(41)42-6)47-15(5)39/h16-17,19-21H,7-10H2,1-6H3,(H,34,40)/t16-,17+,19+,20-,21?,23-/m0/s1