2-(4-chlorophenyl)-3-(diethylamino)quinoline-4-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-3-(diethylamino)quinoline-4-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-3-(diethylamino)quinoline-4-carboxylic acid CAS Name: 2-(4-chlorophenyl)-3-(diethylamino)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-3-(diethylamino)quinoline-4-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-3-(diethylamino)cinchoninic acid Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCN(CC)C1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C20H19ClN2O2/c1-3-23(4-2)19-17(20(24)25)15-7-5-6-8-16(15)22-18(19)13-9-11-14(21)12-10-13/h5-12H,3-4H2,1-2H3,(H,24,25)