trimethyl-[[5-(2-phenylethynyl)furan-2-yl]methyl]azanium iodide

Systemtic Name: trimethyl-[[5-(2-phenylethynyl)furan-2-yl]methyl]azanium iodide Openeye Name: trimethyl-[[5-(2-phenylethynyl)-2-furyl]methyl]ammonium iodide CAS Name: trimethyl-[[5-(2-phenylethynyl)-2-furanyl]methyl]ammonium iodide IUPAC Name: trimethyl-[[5-(2-phenylethynyl)furan-2-yl]methyl]azanium iodide Traditional Name: trimethyl-[[5-(2-phenylethynyl)-2-furyl]methyl]ammonium iodide Formula: C16H18INO MolecularWeight: 367.22469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=CC=C(O1)C#CC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+](C)(C)CC1=CC=C(O1)C#CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C16H18NO.HI/c1-17(2,3)13-16-12-11-15(18-16)10-9-14-7-5-4-6-8-14;/h4-8,11-12H,13H2,1-3H3;1H/q+1;/p-1