trimethyl(1-phenylhex-5-en-1-yn-3-yl)azanium iodide

Systemtic Name: trimethyl(1-phenylhex-5-en-1-yn-3-yl)azanium iodide Openeye Name: trimethyl-[1-(2-phenylethynyl)but-3-enyl]ammonium iodide CAS Name: trimethyl(1-phenylhex-5-en-1-yn-3-yl)ammonium iodide IUPAC Name: trimethyl(1-phenylhex-5-en-1-yn-3-yl)azanium iodide Traditional Name: trimethyl-[1-(2-phenylethynyl)but-3-enyl]ammonium iodide Formula: C15H20IN MolecularWeight: 341.23047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC=C)C#CC1=CC=CC=C1.[I-]

Isomeric SMILES

C[N+](C)(C)C(CC=C)C#CC1=CC=CC=C1.[I-]

InChI

InChI=1S/C15H20N.HI/c1-5-9-15(16(2,3)4)13-12-14-10-7-6-8-11-14;/h5-8,10-11,15H,1,9H2,2-4H3;1H/q+1;/p-1