2-(4-chlorophenyl)-8-ethyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-(4-chlorophenyl)-8-ethyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-8-ethyl-3-hydroxy-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-8-ethyl-3-hydroxy-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-8-ethyl-3-hydroxyquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-8-ethyl-3-hydroxy-cinchoninic acid; triethylamine Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=C(N=C21)C3=CC=C(C=C3)Cl)O)C(=O)O.CCN(CC)CC

Isomeric SMILES

CCC1=CC=CC2=C(C(=C(N=C21)C3=CC=C(C=C3)Cl)O)C(=O)O.CCN(CC)CC

InChI

InChI=1S/C18H14ClNO3.C6H15N/c1-2-10-4-3-5-13-14(18(22)23)17(21)16(20-15(10)13)11-6-8-12(19)9-7-11;1-4-7(5-2)6-3/h3-9,21H,2H2,1H3,(H,22,23);4-6H2,1-3H3