propan-2-yl 4-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzoate

Systemtic Name: propan-2-yl 4-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzoate Openeye Name: isopropyl 4-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzoate CAS Name: 4-[[(8-hydroxy-7-quinolinyl)-pyridin-4-ylmethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(8-hydroxyquinolin-7-yl)-pyridin-4-ylmethyl]amino]benzoate Traditional Name: 4-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzoic acid isopropyl ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O3/c1-16(2)31-25(30)19-5-8-20(9-6-19)28-22(18-11-14-26-15-12-18)21-10-7-17-4-3-13-27-23(17)24(21)29/h3-16,22,28-29H,1-2H3