4-bromanyl-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide

Systemtic Name: 4-bromanyl-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Openeye Name: 4-bromo-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide CAS Name: 4-bromo-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide IUPAC Name: 4-bromo-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Traditional Name: 4-bromo-1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Formula: C19H14BrF3IN MolecularWeight: 520.12484

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=C(C(=C1)C2=CC=CC=C2)Br)C3=CC(=CC=C3)C(F)(F)F.[I-]

Isomeric SMILES

C[N+]1=CC(=C(C(=C1)C2=CC=CC=C2)Br)C3=CC(=CC=C3)C(F)(F)F.[I-]

InChI

InChI=1S/C19H14BrF3N.HI/c1-24-11-16(13-6-3-2-4-7-13)18(20)17(12-24)14-8-5-9-15(10-14)19(21,22)23;/h2-12H,1H3;1H/q+1;/p-1