2-[(3-ethoxycarbonyl-8-phenyl-quinolin-4-yl)amino]benzoic acid hydrochloride

Systemtic Name: 2-[(3-ethoxycarbonyl-8-phenyl-quinolin-4-yl)amino]benzoic acid hydrochloride Openeye Name: 2-[(3-ethoxycarbonyl-8-phenyl-4-quinolyl)amino]benzoic acid hydrochloride CAS Name: 2-[(3-ethoxycarbonyl-8-phenyl-4-quinolinyl)amino]benzoic acid hydrochloride IUPAC Name: 2-[(3-ethoxycarbonyl-8-phenylquinolin-4-yl)amino]benzoic acid hydrochloride Traditional Name: 2-[(3-carbethoxy-8-phenyl-4-quinolyl)amino]benzoic acid hydrochloride Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C(=O)O)C=CC=C2C4=CC=CC=C4.Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C(=O)O)C=CC=C2C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H20N2O4.ClH/c1-2-31-25(30)20-15-26-22-17(16-9-4-3-5-10-16)12-8-13-19(22)23(20)27-21-14-7-6-11-18(21)24(28)29;/h3-15H,2H2,1H3,(H,26,27)(H,28,29);1H