[(1R,2R)-3-methoxy-2-oxidanyl-3-oxidanylidene-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] benzoate

Systemtic Name: [(1R,2R)-3-methoxy-2-oxidanyl-3-oxidanylidene-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] benzoate Openeye Name: [(1R,2R)-2-hydroxy-3-methoxy-3-oxo-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] benzoate CAS Name: benzoic acid [(1R,2R)-2-hydroxy-3-methoxy-3-oxo-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] ester IUPAC Name: [(1R,2R)-2-hydroxy-3-methoxy-3-oxo-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-hydroxy-3-keto-3-methoxy-1-[(2R,4R)-2-phenyl-1,3-dioxan-4-yl]propyl] ester Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1CCOC(O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)[C@@H]([C@H]([C@H]1CCO[C@H](O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H22O7/c1-25-20(24)17(22)18(28-19(23)14-8-4-2-5-9-14)16-12-13-26-21(27-16)15-10-6-3-7-11-15/h2-11,16-18,21-22H,12-13H2,1H3/t16-,17-,18+,21-/m1/s1