6,7-dimethoxy-3-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-1-oxidanylidene-isoquinoline-4-carboxylic acid

Systemtic Name: 6,7-dimethoxy-3-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-1-oxidanylidene-isoquinoline-4-carboxylic acid Openeye Name: 3-(3-hydroxy-4-methoxy-phenyl)-6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carboxylic acid CAS Name: 3-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinecarboxylic acid IUPAC Name: 3-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carboxylic acid Traditional Name: 3-(3-hydroxy-4-methoxy-phenyl)-1-keto-6,7-dimethoxy-2-methyl-isoquinoline-4-carboxylic acid Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)O)C3=CC(=C(C=C3)OC)O

Isomeric SMILES

CN1C(=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)O)C3=CC(=C(C=C3)OC)O

InChI

InChI=1S/C20H19NO7/c1-21-18(10-5-6-14(26-2)13(22)7-10)17(20(24)25)11-8-15(27-3)16(28-4)9-12(11)19(21)23/h5-9,22H,1-4H3,(H,24,25)