sodium 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: sodium 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: sodium 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: sodium 2-(3-pyridinyl)-4-quinolinecarboxylate IUPAC Name: sodium 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: sodium 2-(3-pyridyl)cinchoninate Formula: C15H9N2NaO2 MolecularWeight: 272.23393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10N2O2.Na/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13;/h1-9H,(H,18,19);/q;+1/p-1