potassium 6-bromanyl-2-pyridin-3-yl-quinoline-4-carboxylate

Systemtic Name: potassium 6-bromanyl-2-pyridin-3-yl-quinoline-4-carboxylate Openeye Name: potassium 6-bromo-2-(3-pyridyl)quinoline-4-carboxylate CAS Name: potassium 6-bromo-2-(3-pyridinyl)-4-quinolinecarboxylate IUPAC Name: potassium 6-bromo-2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: potassium 6-bromo-2-(3-pyridyl)cinchoninate Formula: C15H8BrKN2O2 MolecularWeight: 367.23852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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