butyl 3-[[(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate

Systemtic Name: butyl 3-[[(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate Openeye Name: butyl 3-[[(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoate CAS Name: 3-[[(8-hydroxy-7-quinolinyl)-(2-pyridinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[(8-hydroxyquinolin-7-yl)-pyridin-2-ylmethyl]amino]benzoate Traditional Name: 3-[[(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoic acid butyl ester Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=N4

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=N4

InChI

InChI=1S/C26H25N3O3/c1-2-3-16-32-26(31)19-8-6-10-20(17-19)29-24(22-11-4-5-14-27-22)21-13-12-18-9-7-15-28-23(18)25(21)30/h4-15,17,24,29-30H,2-3,16H2,1H3