3-chloranyl-2-(pyridin-1-ium-1-ylmethyl)-5-(trifluoromethyl)pyridine bromide

Systemtic Name: 3-chloranyl-2-(pyridin-1-ium-1-ylmethyl)-5-(trifluoromethyl)pyridine bromide Openeye Name: 3-chloro-2-(pyridin-1-ium-1-ylmethyl)-5-(trifluoromethyl)pyridine bromide CAS Name: 3-chloro-2-(1-pyridin-1-iumylmethyl)-5-(trifluoromethyl)pyridine bromide IUPAC Name: 3-chloro-2-(pyridin-1-ium-1-ylmethyl)-5-(trifluoromethyl)pyridine bromide Traditional Name: 3-chloro-2-(pyridin-1-ium-1-ylmethyl)-5-(trifluoromethyl)pyridine bromide Formula: C12H9BrClF3N2 MolecularWeight: 353.56547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=C(C=C(C=N2)C(F)(F)F)Cl.[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=C(C=C(C=N2)C(F)(F)F)Cl.[Br-]

InChI

InChI=1S/C12H9ClF3N2.BrH/c13-10-6-9(12(14,15)16)7-17-11(10)8-18-4-2-1-3-5-18;/h1-7H,8H2;1H/q+1;/p-1