[4-(4-iodophenyl)phenyl] 2-phenylquinoline-4-carboxylate

Systemtic Name: [4-(4-iodophenyl)phenyl] 2-phenylquinoline-4-carboxylate Openeye Name: [4-(4-iodophenyl)phenyl] 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid [4-(4-iodophenyl)phenyl] ester IUPAC Name: [4-(4-iodophenyl)phenyl] 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid [4-(4-iodophenyl)phenyl] ester Formula: C28H18INO2 MolecularWeight: 527.35249

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)I

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)I

InChI

InChI=1S/C28H18INO2/c29-22-14-10-19(11-15-22)20-12-16-23(17-13-20)32-28(31)25-18-27(21-6-2-1-3-7-21)30-26-9-5-4-8-24(25)26/h1-18H