potassium 7-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: potassium 7-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: potassium 7-bromo-2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: potassium 7-bromo-2-(4-bromophenyl)-4-quinolinecarboxylate IUPAC Name: potassium 7-bromo-2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: potassium 7-bromo-2-(4-bromophenyl)cinchoninate Formula: C16H8Br2KNO2 MolecularWeight: 445.14652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=CC(=C3)Br)C(=C2)C(=O)[O-])Br.[K+]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=CC(=C3)Br)C(=C2)C(=O)[O-])Br.[K+]

InChI

InChI=1S/C16H9Br2NO2.K/c17-10-3-1-9(2-4-10)14-8-13(16(20)21)12-6-5-11(18)7-15(12)19-14;/h1-8H,(H,20,21);/q;+1/p-1