[(2R,3R,4R,5R,6R)-3-acetyloxy-5,6-diethoxy-8-oxidanylidene-2-phenyl-oxocan-4-yl] ethanoate

Systemtic Name: [(2R,3R,4R,5R,6R)-3-acetyloxy-5,6-diethoxy-8-oxidanylidene-2-phenyl-oxocan-4-yl] ethanoate Openeye Name: [(2R,3R,4R,5R,6R)-3-acetoxy-5,6-diethoxy-8-oxo-2-phenyl-oxocan-4-yl] acetate CAS Name: acetic acid [(2R,3R,4R,5R,6R)-3-acetyloxy-5,6-diethoxy-8-oxo-2-phenyl-4-oxocanyl] ester IUPAC Name: [(2R,3R,4R,5R,6R)-3-acetyloxy-5,6-diethoxy-8-oxo-2-phenyloxocan-4-yl] acetate Traditional Name: acetic acid [(2R,3R,4R,5R,6R)-3-acetoxy-5,6-diethoxy-8-keto-2-phenyl-oxocan-4-yl] ester Formula: C21H28O8 MolecularWeight: 408.44222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(=O)OC(C(C(C1OCC)OC(=O)C)OC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCO[C@@H]1CC(=O)O[C@@H]([C@H]([C@@H]([C@@H]1OCC)OC(=O)C)OC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C21H28O8/c1-5-25-16-12-17(24)29-18(15-10-8-7-9-11-15)20(27-13(3)22)21(28-14(4)23)19(16)26-6-2/h7-11,16,18-21H,5-6,12H2,1-4H3/t16-,18-,19-,20-,21-/m1/s1