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

Systemtic Name: [2-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [2-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [2-[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [2-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [2-[4-(4-fluorobenzyl)piperazin-4-ium-1-yl]benzyl]ammonium Formula: C18H24FN3+2 MolecularWeight: 301.401663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C3=CC=CC=C3C[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C3=CC=CC=C3C[NH3+]

InChI

InChI=1S/C18H22FN3/c19-17-7-5-15(6-8-17)14-21-9-11-22(12-10-21)18-4-2-1-3-16(18)13-20/h1-8H,9-14,20H2/p+2