6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: 6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 1-keto-6,7-dimethoxy-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C26H25NO7 MolecularWeight: 463.4792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC(=C(C=C3C(=O)N2C4=CC=C(C=C4)OC)OC)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC(=C(C=C3C(=O)N2C4=CC=C(C=C4)OC)OC)OC)C(=O)O

InChI

InChI=1S/C26H25NO7/c1-31-17-9-5-15(6-10-17)24-23(26(29)30)19-13-21(33-3)22(34-4)14-20(19)25(28)27(24)16-7-11-18(32-2)12-8-16/h5-14,23-24H,1-4H3,(H,29,30)