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

Systemtic Name: 6-[(4-carboxy-2-phenyl-quinolin-6-yl)methyl]-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 6-[(4-carboxy-2-phenyl-6-quinolyl)methyl]-2-phenyl-quinoline-4-carboxylic acid CAS Name: 6-[(4-carboxy-2-phenyl-6-quinolinyl)methyl]-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 6-[(4-carboxy-2-phenylquinolin-6-yl)methyl]-2-phenylquinoline-4-carboxylic acid Traditional Name: 6-[(4-carboxy-2-phenyl-6-quinolyl)methyl]-2-phenyl-cinchoninic acid Formula: C33H22N2O4 MolecularWeight: 510.53878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)CC4=CC5=C(C=C4)N=C(C=C5C(=O)O)C6=CC=CC=C6)C(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)CC4=CC5=C(C=C4)N=C(C=C5C(=O)O)C6=CC=CC=C6)C(=C2)C(=O)O

InChI

InChI=1S/C33H22N2O4/c36-32(37)26-18-30(22-7-3-1-4-8-22)34-28-13-11-20(16-24(26)28)15-21-12-14-29-25(17-21)27(33(38)39)19-31(35-29)23-9-5-2-6-10-23/h1-14,16-19H,15H2,(H,36,37)(H,38,39)