2-[(4-chlorophenyl)methyl]-7-methyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-[(4-chlorophenyl)methyl]-7-methyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-[(4-chlorophenyl)methyl]-3-hydroxy-7-methyl-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-[(4-chlorophenyl)methyl]-3-hydroxy-7-methyl-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-[(4-chlorophenyl)methyl]-3-hydroxy-7-methylquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorobenzyl)-3-hydroxy-7-methyl-cinchoninic acid; triethylamine Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=CC2=NC(=C(C(=C2C=C1)C(=O)O)O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)CC.CC1=CC2=NC(=C(C(=C2C=C1)C(=O)O)O)CC3=CC=C(C=C3)Cl

InChI

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