heptan-4-yl(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: heptan-4-yl(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: 1-propylbutyl(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: heptan-4-yl-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: heptan-4-yl(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: 1-propylbutyl(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C14H32N2+2 MolecularWeight: 228.41728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]CCC[NH+]1CCCC1

Isomeric SMILES

CCCC(CCC)[NH2+]CCC[NH+]1CCCC1

InChI

InChI=1S/C14H30N2/c1-3-8-14(9-4-2)15-10-7-13-16-11-5-6-12-16/h14-15H,3-13H2,1-2H3/p+2