3-(5-methoxy-2-oxidanyl-phenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: 3-(5-methoxy-2-oxidanyl-phenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 3-(2-hydroxy-5-methoxy-phenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 3-(2-hydroxy-5-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 3-(2-hydroxy-5-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 3-(2-hydroxy-5-methoxy-phenyl)-1-keto-2-methyl-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO5/c1-19-16(13-9-10(24-2)7-8-14(13)20)15(18(22)23)11-5-3-4-6-12(11)17(19)21/h3-9,15-16,20H,1-2H3,(H,22,23)