methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-6-methoxy-4-oxidanylidene-2,3-dihydrochromene-3-carboxylate

Systemtic Name: methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-6-methoxy-4-oxidanylidene-2,3-dihydrochromene-3-carboxylate Openeye Name: methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-6-methoxy-4-oxo-chromane-3-carboxylate CAS Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-6-methoxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-6-methoxy-4-oxo-2,3-dihydrochromene-3-carboxylate Traditional Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-4-keto-6-methoxy-chroman-3-carboxylic acid methyl ester Formula: C19H16O7 MolecularWeight: 356.32614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(C(C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC2=C(C=C1)O[C@@H]([C@H](C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16O7/c1-22-11-4-6-13-12(8-11)17(20)16(19(21)23-2)18(26-13)10-3-5-14-15(7-10)25-9-24-14/h3-8,16,18H,9H2,1-2H3/t16-,18+/m0/s1