3-naphthalen-1-ylprop-2-ynyl-(3-phenylprop-2-ynyl)-dipropyl-azanium iodide

Systemtic Name: 3-naphthalen-1-ylprop-2-ynyl-(3-phenylprop-2-ynyl)-dipropyl-azanium iodide Openeye Name: 3-(1-naphthyl)prop-2-ynyl-(3-phenylprop-2-ynyl)-dipropyl-ammonium iodide CAS Name: 3-(1-naphthalenyl)prop-2-ynyl-(3-phenylprop-2-ynyl)-dipropylammonium iodide IUPAC Name: 3-naphthalen-1-ylprop-2-ynyl-(3-phenylprop-2-ynyl)-dipropylazanium iodide Traditional Name: 3-(1-naphthyl)prop-2-ynyl-(3-phenylprop-2-ynyl)-dipropyl-ammonium iodide Formula: C28H30IN MolecularWeight: 507.44897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CC#CC1=CC=CC=C1)CC#CC2=CC=CC3=CC=CC=C32.[I-]

Isomeric SMILES

CCC[N+](CCC)(CC#CC1=CC=CC=C1)CC#CC2=CC=CC3=CC=CC=C32.[I-]

InChI

InChI=1S/C28H30N.HI/c1-3-21-29(22-4-2,23-11-15-25-13-6-5-7-14-25)24-12-19-27-18-10-17-26-16-8-9-20-28(26)27;/h5-10,13-14,16-18,20H,3-4,21-24H2,1-2H3;1H/q+1;/p-1