ethyl 3-[(2-methylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride

Systemtic Name: ethyl 3-[(2-methylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride Openeye Name: ethyl 3-[(2-methyl-4-quinolyl)amino]benzoate; molecular hydrogen; hydrochloride CAS Name: 3-[(2-methyl-4-quinolinyl)amino]benzoic acid ethyl ester; molecular hydrogen; hydrochloride IUPAC Name: ethyl 3-[(2-methylquinolin-4-yl)amino]benzoate; molecular hydrogen; hydrochloride Traditional Name: 3-[(2-methyl-4-quinolyl)amino]benzoic acid ethyl ester; molecular hydrogen; hydrochloride Formula: C19H21ClN2O2 MolecularWeight: 344.83524

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Descriptors Computed from Structure

Canonical SMILES:

[HH].CCOC(=O)C1=CC(=CC=C1)NC2=CC(=NC3=CC=CC=C32)C.Cl

Isomeric SMILES

[HH].CCOC(=O)C1=CC(=CC=C1)NC2=CC(=NC3=CC=CC=C32)C.Cl

InChI

InChI=1S/C19H18N2O2.ClH.H2/c1-3-23-19(22)14-7-6-8-15(12-14)21-18-11-13(2)20-17-10-5-4-9-16(17)18;;/h4-12H,3H2,1-2H3,(H,20,21);2*1H