3-(4-carboxyquinolin-3-yl)quinoline-4-carboxylic acid

Systemtic Name: 3-(4-carboxyquinolin-3-yl)quinoline-4-carboxylic acid Openeye Name: 3-(4-carboxy-3-quinolyl)quinoline-4-carboxylic acid CAS Name: 3-(4-carboxy-3-quinolinyl)-4-quinolinecarboxylic acid IUPAC Name: 3-(4-carboxyquinolin-3-yl)quinoline-4-carboxylic acid Traditional Name: 3-(4-carboxy-3-quinolyl)cinchoninic acid Formula: C20H12N2O4 MolecularWeight: 344.32028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C3=C(C4=CC=CC=C4N=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C3=C(C4=CC=CC=C4N=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H12N2O4/c23-19(24)17-11-5-1-3-7-15(11)21-9-13(17)14-10-22-16-8-4-2-6-12(16)18(14)20(25)26/h1-10H,(H,23,24)(H,25,26)