2-[4-[4-(4-carboxyquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[4-(4-carboxyquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-[4-(4-carboxy-2-quinolyl)phenoxy]phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[4-(4-carboxy-2-quinolinyl)phenoxy]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[4-(4-carboxyquinolin-2-yl)phenoxy]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-[4-(4-carboxy-2-quinolyl)phenoxy]phenyl]cinchoninic acid Formula: C32H20N2O5 MolecularWeight: 512.5116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)OC4=CC=C(C=C4)C5=NC6=CC=CC=C6C(=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)OC4=CC=C(C=C4)C5=NC6=CC=CC=C6C(=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C32H20N2O5/c35-31(36)25-17-29(33-27-7-3-1-5-23(25)27)19-9-13-21(14-10-19)39-22-15-11-20(12-16-22)30-18-26(32(37)38)24-6-2-4-8-28(24)34-30/h1-18H,(H,35,36)(H,37,38)