1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide

Systemtic Name: 1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide Openeye Name: 1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide CAS Name: 1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide IUPAC Name: 1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide Traditional Name: 1-methyl-4-(2-phenylethynyl)pyridin-1-ium iodide Formula: C14H12IN MolecularWeight: 321.15625

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C#CC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C#CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C14H12N.HI/c1-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13;/h2-6,9-12H,1H3;1H/q+1;/p-1