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

Systemtic Name: [(2S,6R)-6-(2-methoxycarbonylprop-2-enyl)-5-oxidanylidene-4-(phenylcarbonyloxy)-2H-pyran-2-yl]methyl benzoate Openeye Name: [(2S,6R)-4-benzoyloxy-6-(2-methoxycarbonylallyl)-5-oxo-2H-pyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,6R)-4-benzoyloxy-6-(2-methoxycarbonylprop-2-enyl)-5-oxo-2H-pyran-2-yl]methyl ester IUPAC Name: [(2S,6R)-4-benzoyloxy-6-(2-methoxycarbonylprop-2-enyl)-5-oxo-2H-pyran-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,6R)-4-benzoyloxy-6-(2-carbomethoxyallyl)-5-keto-2H-pyran-2-yl]methyl ester Formula: C25H22O8 MolecularWeight: 450.43738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)CC1C(=O)C(=CC(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H22O8/c1-16(23(27)30-2)13-20-22(26)21(33-25(29)18-11-7-4-8-12-18)14-19(32-20)15-31-24(28)17-9-5-3-6-10-17/h3-12,14,19-20H,1,13,15H2,2H3/t19-,20+/m0/s1