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

Systemtic Name: 2-(4-chlorophenyl)-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxyquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-cinchoninic acid; triethylamine Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)O)C(=O)O

Isomeric SMILES

CCN(CC)CC.C1=CC=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)O)C(=O)O

InChI

InChI=1S/C16H10ClNO3.C6H15N/c17-10-7-5-9(6-8-10)14-15(19)13(16(20)21)11-3-1-2-4-12(11)18-14;1-4-7(5-2)6-3/h1-8,19H,(H,20,21);4-6H2,1-3H3