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

Systemtic Name: 2-(4-chlorophenyl)-3-oxidanyl-benzo[h]quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-benzo[h]quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-4-benzo[h]quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxybenzo[h]quinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-benzo[h]quinoline-4-carboxylic acid; triethylamine Formula: C26H27ClN2O3 MolecularWeight: 450.95718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC=C2C(=C1)C=CC3=C(C(=C(N=C32)C4=CC=C(C=C4)Cl)O)C(=O)O

Isomeric SMILES

CCN(CC)CC.C1=CC=C2C(=C1)C=CC3=C(C(=C(N=C32)C4=CC=C(C=C4)Cl)O)C(=O)O

InChI

InChI=1S/C20H12ClNO3.C6H15N/c21-13-8-5-12(6-9-13)17-19(23)16(20(24)25)15-10-7-11-3-1-2-4-14(11)18(15)22-17;1-4-7(5-2)6-3/h1-10,23H,(H,24,25);4-6H2,1-3H3