2-(4-chlorophenyl)-3-oxidanyl-6-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-(4-chlorophenyl)-3-oxidanyl-6-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)cinchoninic acid; triethylamine Formula: C23H24ClF3N2O3 MolecularWeight: 468.89647

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC(=CC=C1C2=C(C(=C3C=C(C=CC3=N2)C(F)(F)F)C(=O)O)O)Cl

Isomeric SMILES

CCN(CC)CC.C1=CC(=CC=C1C2=C(C(=C3C=C(C=CC3=N2)C(F)(F)F)C(=O)O)O)Cl

InChI

InChI=1S/C17H9ClF3NO3.C6H15N/c18-10-4-1-8(2-5-10)14-15(23)13(16(24)25)11-7-9(17(19,20)21)3-6-12(11)22-14;1-4-7(5-2)6-3/h1-7,23H,(H,24,25);4-6H2,1-3H3