6-(3-bromanylphenoxy)-5-chloranyl-pyridine-3-carboxylate

Systemtic Name: 6-(3-bromanylphenoxy)-5-chloranyl-pyridine-3-carboxylate Openeye Name: 6-(3-bromophenoxy)-5-chloro-pyridine-3-carboxylate CAS Name: 6-(3-bromophenoxy)-5-chloro-3-pyridinecarboxylate IUPAC Name: 6-(3-bromophenoxy)-5-chloropyridine-3-carboxylate Traditional Name: 6-(3-bromophenoxy)-5-chloro-nicotinate Formula: C12H6BrClNO3- MolecularWeight: 327.53794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OC2=C(C=C(C=N2)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC(=C1)Br)OC2=C(C=C(C=N2)C(=O)[O-])Cl

InChI

InChI=1S/C12H7BrClNO3/c13-8-2-1-3-9(5-8)18-11-10(14)4-7(6-15-11)12(16)17/h1-6H,(H,16,17)/p-1