dimethyl (2R,4aR,10aR)-7-oxidanyl-10-oxidanylidene-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b]chromene-6,8-dicarboxylate

Systemtic Name: dimethyl (2R,4aR,10aR)-7-oxidanyl-10-oxidanylidene-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b]chromene-6,8-dicarboxylate Openeye Name: dimethyl (2R,4aR,10aR)-7-hydroxy-10-oxo-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b]chromene-6,8-dicarboxylate CAS Name: (2R,4aR,10aR)-7-hydroxy-10-oxo-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b][1]benzopyran-6,8-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,4aR,10aR)-7-hydroxy-10-oxo-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b]chromene-6,8-dicarboxylate Traditional Name: (2R,4aR,10aR)-7-hydroxy-10-keto-2-phenyl-4a,10a-dihydro-4H-[1,3]dioxino[5,4-b]chromene-6,8-dicarboxylic acid dimethyl ester Formula: C21H18O9 MolecularWeight: 414.36222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C2C(=C1)C(=O)C3C(O2)COC(O3)C4=CC=CC=C4)C(=O)OC)O

Isomeric SMILES

COC(=O)C1=C(C(=C2C(=C1)C(=O)[C@H]3[C@H](O2)CO[C@H](O3)C4=CC=CC=C4)C(=O)OC)O

InChI

InChI=1S/C21H18O9/c1-26-19(24)12-8-11-16(23)18-13(29-17(11)14(15(12)22)20(25)27-2)9-28-21(30-18)10-6-4-3-5-7-10/h3-8,13,18,21-22H,9H2,1-2H3/t13-,18-,21-/m1/s1