methyl (1S,2R,3R,4R,5S,6R)-3-acetyloxy-2-oxidanyl-5-phenyl-4-(phenylcarbonyloxymethyl)bicyclo[2.2.2]oct-7-ene-6-carboxylate

Systemtic Name: methyl (1S,2R,3R,4R,5S,6R)-3-acetyloxy-2-oxidanyl-5-phenyl-4-(phenylcarbonyloxymethyl)bicyclo[2.2.2]oct-7-ene-6-carboxylate Openeye Name: methyl (1S,2R,3R,4R,5S,6R)-3-acetoxy-4-(benzoyloxymethyl)-2-hydroxy-5-phenyl-bicyclo[2.2.2]oct-7-ene-6-carboxylate CAS Name: (1S,2R,3R,4R,5S,6R)-3-acetyloxy-4-(benzoyloxymethyl)-2-hydroxy-5-phenyl-6-bicyclo[2.2.2]oct-7-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R,3R,4R,5S,6R)-3-acetyloxy-4-(benzoyloxymethyl)-2-hydroxy-5-phenylbicyclo[2.2.2]oct-7-ene-6-carboxylate Traditional Name: (1S,2R,3R,4R,5S,6R)-3-acetoxy-4-(benzoyloxymethyl)-2-hydroxy-5-phenyl-bicyclo[2.2.2]oct-7-ene-6-carboxylic acid methyl ester Formula: C26H26O7 MolecularWeight: 450.48044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2C=CC1(C(C2C(=O)OC)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(=O)O[C@H]1[C@@H]([C@H]2C=C[C@@]1([C@@H]([C@H]2C(=O)OC)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C26H26O7/c1-16(27)33-23-22(28)19-13-14-26(23,15-32-24(29)18-11-7-4-8-12-18)21(20(19)25(30)31-2)17-9-5-3-6-10-17/h3-14,19-23,28H,15H2,1-2H3/t19-,20-,21+,22+,23-,26-/m0/s1