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

Systemtic Name: 2-(4-chlorophenyl)-6-methyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-6-methyl-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-6-methyl-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxy-6-methylquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-6-methyl-cinchoninic acid; triethylamine Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)Cl)O)C(=O)O

Isomeric SMILES

CCN(CC)CC.CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)Cl)O)C(=O)O

InChI

InChI=1S/C17H12ClNO3.C6H15N/c1-9-2-7-13-12(8-9)14(17(21)22)16(20)15(19-13)10-3-5-11(18)6-4-10;1-4-7(5-2)6-3/h2-8,20H,1H3,(H,21,22);4-6H2,1-3H3