methyl (2R,3R,4S)-3-acetamido-4-acetyloxy-2-[(1S,2R)-1,2-diacetyloxy-3-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octoxymethoxy]propyl]-3,4-dihydro-2H-pyran-6-carboxylate

Systemtic Name: methyl (2R,3R,4S)-3-acetamido-4-acetyloxy-2-[(1S,2R)-1,2-diacetyloxy-3-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octoxymethoxy]propyl]-3,4-dihydro-2H-pyran-6-carboxylate Openeye Name: methyl (2R,3R,4S)-3-acetamido-4-acetoxy-2-[(1S,2R)-1,2-diacetoxy-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxymethoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylate CAS Name: (2R,3R,4S)-3-acetamido-4-acetyloxy-2-[(1S,2R)-1,2-diacetyloxy-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxymethoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester IUPAC Name: methyl (2R,3R,4S)-3-acetamido-4-acetyloxy-2-[(1S,2R)-1,2-diacetyloxy-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxymethoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylate Traditional Name: (2R,3R,4S)-3-acetamido-4-acetoxy-2-[(1S,2R)-1,2-diacetoxy-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxymethoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid methyl ester Formula: C27H30F13NO12 MolecularWeight: 807.505842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(C(COCOCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(=O)C)OC(=O)C)C(=O)OC)OC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1[C@@H]([C@@H](COCOCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(=O)C)OC(=O)C)C(=O)OC)OC(=O)C

InChI

InChI=1S/C27H30F13NO12/c1-11(42)41-18-15(50-12(2)43)8-16(21(46)47-5)53-20(18)19(52-14(4)45)17(51-13(3)44)9-49-10-48-7-6-22(28,29)23(30,31)24(32,33)25(34,35)26(36,37)27(38,39)40/h8,15,17-20H,6-7,9-10H2,1-5H3,(H,41,42)/t15-,17+,18+,19+,20+/m0/s1