1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide

Systemtic Name: 1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Openeye Name: 1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide CAS Name: 1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide IUPAC Name: 1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Traditional Name: 1-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Formula: C13H11F3IN MolecularWeight: 365.13282

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC(=CC=C2)C(F)(F)F.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC(=CC=C2)C(F)(F)F.[I-]

InChI

InChI=1S/C13H11F3N.HI/c1-17-7-5-10(6-8-17)11-3-2-4-12(9-11)13(14,15)16;/h2-9H,1H3;1H/q+1;/p-1