1-ethyl-4-iodanyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide

Systemtic Name: 1-ethyl-4-iodanyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Openeye Name: 1-ethyl-4-iodo-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide CAS Name: 1-ethyl-4-iodo-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide IUPAC Name: 1-ethyl-4-iodo-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Traditional Name: 1-ethyl-4-iodo-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium iodide Formula: C20H16F3I2N MolecularWeight: 581.15189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16F3IN.HI/c1-2-25-12-17(14-7-4-3-5-8-14)19(24)18(13-25)15-9-6-10-16(11-15)20(21,22)23;/h3-13H,2H2,1H3;1H/q+1;/p-1