methyl 5-methoxy-2-[3-methyl-6,8-bis(oxidanyl)-1-oxidanylidene-isochromen-7-yl]carbonyl-3-oxidanyl-benzoate

Systemtic Name: methyl 5-methoxy-2-[3-methyl-6,8-bis(oxidanyl)-1-oxidanylidene-isochromen-7-yl]carbonyl-3-oxidanyl-benzoate Openeye Name: methyl 2-(6,8-dihydroxy-3-methyl-1-oxo-isochromene-7-carbonyl)-3-hydroxy-5-methoxy-benzoate CAS Name: 2-[(6,8-dihydroxy-3-methyl-1-oxo-2-benzopyran-7-yl)-oxomethyl]-3-hydroxy-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-(6,8-dihydroxy-3-methyl-1-oxoisochromene-7-carbonyl)-3-hydroxy-5-methoxybenzoate Traditional Name: 2-(6,8-dihydroxy-1-keto-3-methyl-isochromene-7-carbonyl)-3-hydroxy-5-methoxy-benzoic acid methyl ester Formula: C20H16O9 MolecularWeight: 400.33564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)C3=C(C=C(C=C3C(=O)OC)OC)O)O

Isomeric SMILES

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)C3=C(C=C(C=C3C(=O)OC)OC)O)O

InChI

InChI=1S/C20H16O9/c1-8-4-9-5-12(21)16(17(23)14(9)20(26)29-8)18(24)15-11(19(25)28-3)6-10(27-2)7-13(15)22/h4-7,21-23H,1-3H3