sodium 6-[2-[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]phenyl]pyridine-2-carboxylate

Systemtic Name: sodium 6-[2-[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]phenyl]pyridine-2-carboxylate Openeye Name: sodium 6-[2-[5-bromo-2-(2-chloroallyloxy)phenyl]phenyl]pyridine-2-carboxylate CAS Name: sodium 6-[2-[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]phenyl]-2-pyridinecarboxylate IUPAC Name: sodium 6-[2-[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]phenyl]pyridine-2-carboxylate Traditional Name: sodium 6-[2-[5-bromo-2-(2-chloroallyloxy)phenyl]phenyl]picolinate Formula: C21H14BrClNNaO3 MolecularWeight: 466.68753

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC1=C(C=C(C=C1)Br)C2=CC=CC=C2C3=NC(=CC=C3)C(=O)[O-])Cl.[Na+]

Isomeric SMILES

C=C(COC1=C(C=C(C=C1)Br)C2=CC=CC=C2C3=NC(=CC=C3)C(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C21H15BrClNO3.Na/c1-13(23)12-27-20-10-9-14(22)11-17(20)15-5-2-3-6-16(15)18-7-4-8-19(24-18)21(25)26;/h2-11H,1,12H2,(H,25,26);/q;+1/p-1