ethyl 4-[(3-cyanoquinolin-4-yl)amino]benzoate hydrochloride

Systemtic Name: ethyl 4-[(3-cyanoquinolin-4-yl)amino]benzoate hydrochloride Openeye Name: ethyl 4-[(3-cyano-4-quinolyl)amino]benzoate hydrochloride CAS Name: 4-[(3-cyano-4-quinolinyl)amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[(3-cyanoquinolin-4-yl)amino]benzoate hydrochloride Traditional Name: 4-[(3-cyano-4-quinolyl)amino]benzoic acid ethyl ester hydrochloride Formula: C19H16ClN3O2 MolecularWeight: 353.80224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N.Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N.Cl

InChI

InChI=1S/C19H15N3O2.ClH/c1-2-24-19(23)13-7-9-15(10-8-13)22-18-14(11-20)12-21-17-6-4-3-5-16(17)18;/h3-10,12H,2H2,1H3,(H,21,22);1H