3-bromanylprop-2-ynyl(trioctyl)azanium

Systemtic Name: 3-bromanylprop-2-ynyl(trioctyl)azanium Openeye Name: 3-bromoprop-2-ynyl(trioctyl)ammonium CAS Name: 3-bromoprop-2-ynyl(trioctyl)ammonium IUPAC Name: 3-bromoprop-2-ynyl(trioctyl)azanium Traditional Name: 3-bromoprop-2-ynyl(trioctyl)ammonium Formula: C27H53BrN+ MolecularWeight: 471.62042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC#CBr

Isomeric SMILES

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC#CBr

InChI

InChI=1S/C27H53BrN/c1-4-7-10-13-16-19-24-29(27-22-23-28,25-20-17-14-11-8-5-2)26-21-18-15-12-9-6-3/h4-21,24-27H2,1-3H3/q+1