ethyl 4-[(6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]benzoate hydrochloride

Systemtic Name: ethyl 4-[(6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]benzoate hydrochloride Openeye Name: ethyl 4-[[6-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]benzoate hydrochloride CAS Name: 4-[[[6-chloro-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[(6-chloro-2-pyridin-3-ylquinoline-4-carbonyl)amino]benzoate hydrochloride Traditional Name: 4-[[6-chloro-2-(3-pyridyl)quinoline-4-carbonyl]amino]benzoic acid ethyl ester hydrochloride Formula: C24H19Cl2N3O3 MolecularWeight: 468.33196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4.Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4.Cl

InChI

InChI=1S/C24H18ClN3O3.ClH/c1-2-31-24(30)15-5-8-18(9-6-15)27-23(29)20-13-22(16-4-3-11-26-14-16)28-21-10-7-17(25)12-19(20)21;/h3-14H,2H2,1H3,(H,27,29);1H