potassium 6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxylate

Systemtic Name: potassium 6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxylate Openeye Name: potassium 6,8-dimethyl-2-(3-pyridyl)quinoline-4-carboxylate CAS Name: potassium 6,8-dimethyl-2-(3-pyridinyl)-4-quinolinecarboxylate IUPAC Name: potassium 6,8-dimethyl-2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: potassium 6,8-dimethyl-2-(3-pyridyl)cinchoninate Formula: C17H13KN2O2 MolecularWeight: 316.39562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)[O-])C.[K+]

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)[O-])C.[K+]

InChI

InChI=1S/C17H14N2O2.K/c1-10-6-11(2)16-13(7-10)14(17(20)21)8-15(19-16)12-4-3-5-18-9-12;/h3-9H,1-2H3,(H,20,21);/q;+1/p-1