1-methyl-4-[5-(trifluoromethyl)-1-benzofuran-2-yl]pyridin-1-ium iodide

Systemtic Name: 1-methyl-4-[5-(trifluoromethyl)-1-benzofuran-2-yl]pyridin-1-ium iodide Openeye Name: 1-methyl-4-[5-(trifluoromethyl)benzofuran-2-yl]pyridin-1-ium iodide CAS Name: 1-methyl-4-[5-(trifluoromethyl)-2-benzofuranyl]pyridin-1-ium iodide IUPAC Name: 1-methyl-4-[5-(trifluoromethyl)-1-benzofuran-2-yl]pyridin-1-ium iodide Traditional Name: 1-methyl-4-[5-(trifluoromethyl)benzofuran-2-yl]pyridin-1-ium iodide Formula: C15H11F3INO MolecularWeight: 405.15362

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC3=C(O2)C=CC(=C3)C(F)(F)F.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC3=C(O2)C=CC(=C3)C(F)(F)F.[I-]

InChI

InChI=1S/C15H11F3NO.HI/c1-19-6-4-10(5-7-19)14-9-11-8-12(15(16,17)18)2-3-13(11)20-14;/h2-9H,1H3;1H/q+1;/p-1