2-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)methyl]-4,5-dimethoxy-benzoic acid

Systemtic Name: 2-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)methyl]-4,5-dimethoxy-benzoic acid Openeye Name: 2-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]-4,5-dimethoxy-benzoic acid CAS Name: 2-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]-4,5-dimethoxybenzoic acid IUPAC Name: 2-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]-4,5-dimethoxybenzoic acid Traditional Name: 2-[bis(2-hydroxy-4-keto-6-methyl-1H-pyridin-3-yl)methyl]-4,5-dimethoxy-benzoic acid Formula: C22H22N2O8 MolecularWeight: 442.41868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1)O)C(C2=CC(=C(C=C2C(=O)O)OC)OC)C3=C(NC(=CC3=O)C)O

Isomeric SMILES

CC1=CC(=O)C(=C(N1)O)C(C2=CC(=C(C=C2C(=O)O)OC)OC)C3=C(NC(=CC3=O)C)O

InChI

InChI=1S/C22H22N2O8/c1-9-5-13(25)18(20(27)23-9)17(19-14(26)6-10(2)24-21(19)28)11-7-15(31-3)16(32-4)8-12(11)22(29)30/h5-8,17H,1-4H3,(H,29,30)(H2,23,25,27)(H2,24,26,28)