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

Systemtic Name: 6-bromanyl-2-(4-chlorophenyl)-8-methyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 6-bromo-2-(4-chlorophenyl)-3-hydroxy-8-methyl-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 6-bromo-2-(4-chlorophenyl)-3-hydroxy-8-methyl-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 6-bromo-2-(4-chlorophenyl)-3-hydroxy-8-methylquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 6-bromo-2-(4-chlorophenyl)-3-hydroxy-8-methyl-cinchoninic acid; triethylamine Formula: C23H26BrClN2O3 MolecularWeight: 493.82114

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=C(C=C3)Cl)O)C(=O)O

Isomeric SMILES

CCN(CC)CC.CC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=C(C=C3)Cl)O)C(=O)O

InChI

InChI=1S/C17H11BrClNO3.C6H15N/c1-8-6-10(18)7-12-13(17(22)23)16(21)15(20-14(8)12)9-2-4-11(19)5-3-9;1-4-7(5-2)6-3/h2-7,21H,1H3,(H,22,23);4-6H2,1-3H3