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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC(=CC=C2)F)C3=CC=CC=C3C[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC(=CC=C2)F)C3=CC=CC=C3C[NH3+]

InChI

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