[(2R,3R,4S,5S,6R)-5-(phenylcarbonyloxy)-4-prop-2-enoxy-2-(prop-2-enoxymethyl)-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-3-yl] benzoate

Systemtic Name: [(2R,3R,4S,5S,6R)-5-(phenylcarbonyloxy)-4-prop-2-enoxy-2-(prop-2-enoxymethyl)-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-3-yl] benzoate Openeye Name: [(2R,3R,4S,5S,6R)-4-allyloxy-2-(allyloxymethyl)-5-benzoyloxy-6-(2,2,2-trichloroethanimidoyl)oxy-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4S,5S,6R)-5-benzoyloxy-4-prop-2-enoxy-2-(prop-2-enoxymethyl)-6-(2,2,2-trichloro-1-iminoethoxy)-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6R)-5-benzoyloxy-4-prop-2-enoxy-2-(prop-2-enoxymethyl)-6-(2,2,2-trichloroethanimidoyl)oxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4S,5S,6R)-4-allyloxy-2-(allyloxymethyl)-5-benzoyloxy-6-(2,2,2-trichloroacetimidoyl)oxy-tetrahydropyran-3-yl] ester Formula: C28H28Cl3NO8 MolecularWeight: 612.88282

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOCC1C(C(C(C(O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C2=CC=CC=C2)OCC=C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C=CCOC[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C2=CC=CC=C2)OCC=C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H28Cl3NO8/c1-3-15-35-17-20-21(38-24(33)18-11-7-5-8-12-18)22(36-16-4-2)23(26(37-20)40-27(32)28(29,30)31)39-25(34)19-13-9-6-10-14-19/h3-14,20-23,26,32H,1-2,15-17H2/t20-,21-,22+,23+,26-/m1/s1