[5-bromanyl-4-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(pyridin-2-ylamino)methyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [5-bromanyl-4-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(pyridin-2-ylamino)methyl]-2-methoxy-phenyl] ethanoate Openeye Name: [5-bromo-4-[(5-chloro-8-hydroxy-7-quinolyl)-(2-pyridylamino)methyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [5-bromo-4-[(5-chloro-8-hydroxy-7-quinolinyl)-(2-pyridinylamino)methyl]-2-methoxyphenyl] ester IUPAC Name: [5-bromo-4-[(5-chloro-8-hydroxyquinolin-7-yl)-(pyridin-2-ylamino)methyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [5-bromo-4-[(5-chloro-8-hydroxy-7-quinolyl)-(2-pyridylamino)methyl]-2-methoxy-phenyl] ester Formula: C24H19BrClN3O4 MolecularWeight: 528.78236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C(=C1)Br)C(C2=CC(=C3C=CC=NC3=C2O)Cl)NC4=CC=CC=N4)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C(=C1)Br)C(C2=CC(=C3C=CC=NC3=C2O)Cl)NC4=CC=CC=N4)OC

InChI

InChI=1S/C24H19BrClN3O4/c1-13(30)33-20-12-17(25)15(11-19(20)32-2)22(29-21-7-3-4-8-27-21)16-10-18(26)14-6-5-9-28-23(14)24(16)31/h3-12,22,31H,1-2H3,(H,27,29)