4-(2-carboxyethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 4-(2-carboxyethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid hydrochloride Openeye Name: 4-(2-carboxyethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid hydrochloride CAS Name: 4-(2-carboxyethylamino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 4-(2-carboxyethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid hydrochloride Traditional Name: 4-(2-carboxyethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid hydrochloride Formula: C14H12ClF3N2O4 MolecularWeight: 364.70429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)O)NCCC(=O)O.Cl

Isomeric SMILES

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)O)NCCC(=O)O.Cl

InChI

InChI=1S/C14H11F3N2O4.ClH/c15-14(16,17)9-3-1-2-7-11(18-5-4-10(20)21)8(13(22)23)6-19-12(7)9;/h1-3,6H,4-5H2,(H,18,19)(H,20,21)(H,22,23);1H