2-[4-[4-(4-carboxy-6-chloranyl-quinolin-2-yl)phenyl]phenyl]-6-chloranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[4-(4-carboxy-6-chloranyl-quinolin-2-yl)phenyl]phenyl]-6-chloranyl-quinoline-4-carboxylic acid Openeye Name: 2-[4-[4-(4-carboxy-6-chloro-2-quinolyl)phenyl]phenyl]-6-chloro-quinoline-4-carboxylic acid CAS Name: 2-[4-[4-(4-carboxy-6-chloro-2-quinolinyl)phenyl]phenyl]-6-chloro-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[4-(4-carboxy-6-chloroquinolin-2-yl)phenyl]phenyl]-6-chloroquinoline-4-carboxylic acid Traditional Name: 2-[4-[4-(4-carboxy-6-chloro-2-quinolyl)phenyl]phenyl]-6-chloro-cinchoninic acid Formula: C32H18Cl2N2O4 MolecularWeight: 565.40232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)O)C5=NC6=C(C=C(C=C6)Cl)C(=C5)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)O)C5=NC6=C(C=C(C=C6)Cl)C(=C5)C(=O)O

InChI

InChI=1S/C32H18Cl2N2O4/c33-21-9-11-27-23(13-21)25(31(37)38)15-29(35-27)19-5-1-17(2-6-19)18-3-7-20(8-4-18)30-16-26(32(39)40)24-14-22(34)10-12-28(24)36-30/h1-16H,(H,37,38)(H,39,40)