2-(pyridin-3-ylcarbonylamino)ethyl 2-[(7-bromanylquinolin-4-yl)amino]benzoate

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl 2-[(7-bromanylquinolin-4-yl)amino]benzoate Openeye Name: 2-(pyridine-3-carbonylamino)ethyl 2-[(7-bromo-4-quinolyl)amino]benzoate CAS Name: 2-[(7-bromo-4-quinolinyl)amino]benzoic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl 2-[(7-bromoquinolin-4-yl)amino]benzoate Traditional Name: 2-[(7-bromo-4-quinolyl)amino]benzoic acid 2-nicotinamidoethyl ester Formula: C24H19BrN4O3 MolecularWeight: 491.33666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCCNC(=O)C2=CN=CC=C2)NC3=C4C=CC(=CC4=NC=C3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCCNC(=O)C2=CN=CC=C2)NC3=C4C=CC(=CC4=NC=C3)Br

InChI

InChI=1S/C24H19BrN4O3/c25-17-7-8-18-21(9-11-27-22(18)14-17)29-20-6-2-1-5-19(20)24(31)32-13-12-28-23(30)16-4-3-10-26-15-16/h1-11,14-15H,12-13H2,(H,27,29)(H,28,30)