[1-[(2S,3S,4R,5S,6R)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]-3-fluoranyl-propan-2-yl] benzoate

Systemtic Name: [1-[(2S,3S,4R,5S,6R)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]-3-fluoranyl-propan-2-yl] benzoate Openeye Name: [1-[[(2S,3S,4R,5S,6R)-4-benzyloxy-6-(benzyloxymethyl)-3-(1,3-dioxoisoindolin-2-yl)-5-hydroxy-tetrahydropyran-2-yl]methyl]-2-fluoro-ethyl] benzoate CAS Name: benzoic acid [1-[(2S,3S,4R,5S,6R)-3-(1,3-dioxo-2-isoindolyl)-5-hydroxy-4-phenylmethoxy-6-(phenylmethoxymethyl)-2-oxanyl]-3-fluoropropan-2-yl] ester IUPAC Name: [1-[(2S,3S,4R,5S,6R)-3-(1,3-dioxoisoindol-2-yl)-5-hydroxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-2-yl]-3-fluoropropan-2-yl] benzoate Traditional Name: benzoic acid [1-[[(2S,3S,4R,5S,6R)-4-benzoxy-6-(benzoxymethyl)-5-hydroxy-3-phthalimido-tetrahydropyran-2-yl]methyl]-2-fluoro-ethyl] ester Formula: C38H36FNO8 MolecularWeight: 653.692743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(C(C(C(O2)CC(CF)OC(=O)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)OCC6=CC=CC=C6)O

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CC(CF)OC(=O)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)OCC6=CC=CC=C6)O

InChI

InChI=1S/C38H36FNO8/c39-21-28(47-38(44)27-16-8-3-9-17-27)20-31-33(40-36(42)29-18-10-11-19-30(29)37(40)43)35(46-23-26-14-6-2-7-15-26)34(41)32(48-31)24-45-22-25-12-4-1-5-13-25/h1-19,28,31-35,41H,20-24H2/t28?,31-,32+,33-,34+,35+/m0/s1