[2,3,4,5,6-pentakis(fluoranyl)phenyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]amino]butanoate

Systemtic Name: [2,3,4,5,6-pentakis(fluoranyl)phenyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]amino]butanoate Openeye Name: (2,3,4,5,6-pentafluorophenyl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]amino]butanoate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxo-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]amino]butanoic acid (2,3,4,5,6-pentafluorophenyl) ester IUPAC Name: (2,3,4,5,6-pentafluorophenyl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]amino]butanoate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]amino]butyric acid (2,3,4,5,6-pentafluorophenyl) ester Formula: C39H35F5N2O14 MolecularWeight: 850.692216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)NC(=O)CC(C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)NC(=O)C[C@@H](C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C39H35F5N2O14/c1-16(47)54-15-26-33(56-17(2)48)35(57-18(3)49)36(58-19(4)50)37(59-26)46-27(51)13-25(38(52)60-34-31(43)29(41)28(40)30(42)32(34)44)45-39(53)55-14-24-22-11-7-5-9-20(22)21-10-6-8-12-23(21)24/h5-12,24-26,33,35-37H,13-15H2,1-4H3,(H,45,53)(H,46,51)/t25-,26+,33-,35-,36+,37+/m0/s1