[4-[4-[3-(2-fluorophenyl)propyl]piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [4-[4-[3-(2-fluorophenyl)propyl]piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-[4-[3-(2-fluorophenyl)propyl]piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [4-[4-[3-(2-fluorophenyl)propyl]-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-[4-[3-(2-fluorophenyl)propyl]piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [4-[4-[3-(2-fluorophenyl)propyl]piperazin-4-ium-1-yl]benzyl]ammonium Formula: C20H28FN3+2 MolecularWeight: 329.454823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CC=C2F)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CC=C2F)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C20H26FN3/c21-20-6-2-1-4-18(20)5-3-11-23-12-14-24(15-13-23)19-9-7-17(16-22)8-10-19/h1-2,4,6-10H,3,5,11-16,22H2/p+2