sodium 6-[[5-chloranyl-2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]phenyl]methyl]pyridine-2-carboxylate

Systemtic Name: sodium 6-[[5-chloranyl-2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]phenyl]methyl]pyridine-2-carboxylate Openeye Name: sodium 6-[[5-chloro-2-[(2-chloro-4-fluoro-phenyl)methoxy]phenyl]methyl]pyridine-2-carboxylate CAS Name: sodium 6-[[5-chloro-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methyl]-2-pyridinecarboxylate IUPAC Name: sodium 6-[[5-chloro-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methyl]pyridine-2-carboxylate Traditional Name: sodium 6-[5-chloro-2-(2-chloro-4-fluoro-benzyl)oxy-benzyl]picolinate Formula: C20H13Cl2FNNaO3 MolecularWeight: 428.216293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)CC2=C(C=CC(=C2)Cl)OCC3=C(C=C(C=C3)F)Cl)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=NC(=C1)CC2=C(C=CC(=C2)Cl)OCC3=C(C=C(C=C3)F)Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H14Cl2FNO3.Na/c21-14-5-7-19(27-11-12-4-6-15(23)10-17(12)22)13(8-14)9-16-2-1-3-18(24-16)20(25)26;/h1-8,10H,9,11H2,(H,25,26);/q;+1/p-1