[(2S,6R)-6-(2-hydroxyethyloxy)-5-oxidanylidene-4-(phenylcarbonyloxy)-2H-pyran-2-yl]methyl benzoate

Systemtic Name: [(2S,6R)-6-(2-hydroxyethyloxy)-5-oxidanylidene-4-(phenylcarbonyloxy)-2H-pyran-2-yl]methyl benzoate Openeye Name: [(2S,6R)-4-benzoyloxy-6-(2-hydroxyethoxy)-5-oxo-2H-pyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,6R)-4-benzoyloxy-6-(2-hydroxyethoxy)-5-oxo-2H-pyran-2-yl]methyl ester IUPAC Name: [(2S,6R)-4-benzoyloxy-6-(2-hydroxyethoxy)-5-oxo-2H-pyran-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,6R)-4-benzoyloxy-6-(2-hydroxyethoxy)-5-keto-2H-pyran-2-yl]methyl ester Formula: C22H20O8 MolecularWeight: 412.3894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C=C(C(=O)C(O2)OCCO)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC[C@@H]2C=C(C(=O)[C@@H](O2)OCCO)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20O8/c23-11-12-27-22-19(24)18(30-21(26)16-9-5-2-6-10-16)13-17(29-22)14-28-20(25)15-7-3-1-4-8-15/h1-10,13,17,22-23H,11-12,14H2/t17-,22+/m0/s1