3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propylazanium

Systemtic Name: 3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propylazanium Openeye Name: 3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propylammonium CAS Name: 3-[4-[3-(trifluoromethyl)phenyl]-1-piperazin-1-iumyl]propylammonium IUPAC Name: 3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propylazanium Traditional Name: 3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propylammonium Formula: C14H22F3N3+2 MolecularWeight: 289.33979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC[NH3+])C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1CCC[NH3+])C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H20F3N3/c15-14(16,17)12-3-1-4-13(11-12)20-9-7-19(8-10-20)6-2-5-18/h1,3-4,11H,2,5-10,18H2/p+2