2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)quinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-methyl-8-(trifluoromethyl)cinchoninic acid; triethylamine Formula: C24H26ClF3N2O2 MolecularWeight: 466.92365

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=C(N=C2C(=C1C(=O)O)C=CC=C2C(F)(F)F)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)CC.CC1=C(N=C2C(=C1C(=O)O)C=CC=C2C(F)(F)F)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H11ClF3NO2.C6H15N/c1-9-14(17(24)25)12-3-2-4-13(18(20,21)22)16(12)23-15(9)10-5-7-11(19)8-6-10;1-4-7(5-2)6-3/h2-8H,1H3,(H,24,25);4-6H2,1-3H3