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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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