methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-4-oxidanylidene-2,3-dihydrochromene-3-carboxylate

Systemtic Name: methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-4-oxidanylidene-2,3-dihydrochromene-3-carboxylate Openeye Name: methyl (2S,3R)-2-(1,3-benzodioxol-5-yl)-8-methoxy-4-oxo-chromane-3-carboxylate CAS Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-8-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)-8-methoxy-4-oxo-2,3-dihydrochromene-3-carboxylate Traditional Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-4-keto-8-methoxy-chroman-3-carboxylic acid methyl ester Formula: C19H16O7 MolecularWeight: 356.32614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(C(C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC2=C1O[C@@H]([C@H](C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16O7/c1-22-13-5-3-4-11-16(20)15(19(21)23-2)17(26-18(11)13)10-6-7-12-14(8-10)25-9-24-12/h3-8,15,17H,9H2,1-2H3/t15-,17+/m0/s1