5-bromanyl-2-pyridin-4-yl-quinoline-4-carboxylate

Systemtic Name: 5-bromanyl-2-pyridin-4-yl-quinoline-4-carboxylate Openeye Name: 5-bromo-2-(4-pyridyl)quinoline-4-carboxylate CAS Name: 5-bromo-2-pyridin-4-yl-4-quinolinecarboxylate IUPAC Name: 5-bromo-2-pyridin-4-ylquinoline-4-carboxylate Traditional Name: 5-bromo-2-(4-pyridyl)cinchoninate Formula: C15H8BrN2O2- MolecularWeight: 328.14022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CC(=N2)C3=CC=NC=C3)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CC(=N2)C3=CC=NC=C3)C(=O)[O-]

InChI

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