2-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]ethylazanium

Systemtic Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[(3-fluorophenyl)methyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[(3-fluorophenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-(3-fluorobenzyl)piperazin-4-ium-1-yl]ethylammonium Formula: C13H22FN3+2 MolecularWeight: 239.332283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20FN3/c14-13-3-1-2-12(10-13)11-17-8-6-16(5-4-15)7-9-17/h1-3,10H,4-9,11,15H2/p+2