2-(4-chlorophenyl)-3-oxidanyl-quinoline-4,8-dicarboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-(4-chlorophenyl)-3-oxidanyl-quinoline-4,8-dicarboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-quinoline-4,8-dicarboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-hydroxyquinoline-4,8-dicarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxyquinoline-4,8-dicarboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-quinoline-4,8-dicarboxylic acid; triethylamine Formula: C23H25ClN2O5 MolecularWeight: 444.908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10ClNO5.C6H15N/c18-9-6-4-8(5-7-9)13-15(20)12(17(23)24)10-2-1-3-11(16(21)22)14(10)19-13;1-4-7(5-2)6-3/h1-7,20H,(H,21,22)(H,23,24);4-6H2,1-3H3