dimethyl 2-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(8-hydroxy-7-quinolinyl)-pyridin-4-ylmethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[(8-hydroxyquinolin-7-yl)-pyridin-4-ylmethyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(C2=CC=NC=C2)C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(C2=CC=NC=C2)C3=C(C4=C(C=CC=N4)C=C3)O

InChI

InChI=1S/C25H21N3O5/c1-32-24(30)17-6-7-18(25(31)33-2)20(14-17)28-21(16-9-12-26-13-10-16)19-8-5-15-4-3-11-27-22(15)23(19)29/h3-14,21,28-29H,1-2H3