potassium 6-bromanyl-2-pyridin-4-yl-quinoline-4-carboxylate

Systemtic Name: potassium 6-bromanyl-2-pyridin-4-yl-quinoline-4-carboxylate Openeye Name: potassium 6-bromo-2-(4-pyridyl)quinoline-4-carboxylate CAS Name: potassium 6-bromo-2-pyridin-4-yl-4-quinolinecarboxylate IUPAC Name: potassium 6-bromo-2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: potassium 6-bromo-2-(4-pyridyl)cinchoninate Formula: C15H8BrKN2O2 MolecularWeight: 367.23852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CC(=N2)C3=CC=NC=C3)C(=O)[O-].[K+]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CC(=N2)C3=CC=NC=C3)C(=O)[O-].[K+]

InChI

InChI=1S/C15H9BrN2O2.K/c16-10-1-2-13-11(7-10)12(15(19)20)8-14(18-13)9-3-5-17-6-4-9;/h1-8H,(H,19,20);/q;+1/p-1