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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=CC=CC2=C(C(=C(N=C12)CC3=CC=C(C=C3)Cl)O)C(=O)O

Isomeric SMILES

CCN(CC)CC.CC1=CC=CC2=C(C(=C(N=C12)CC3=CC=C(C=C3)Cl)O)C(=O)O

InChI

InChI=1S/C18H14ClNO3.C6H15N/c1-10-3-2-4-13-15(18(22)23)17(21)14(20-16(10)13)9-11-5-7-12(19)8-6-11;1-4-7(5-2)6-3/h2-8,21H,9H2,1H3,(H,22,23);4-6H2,1-3H3