3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]propylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20FN3/c14-12-2-4-13(5-3-12)17-10-8-16(9-11-17)7-1-6-15/h2-5H,1,6-11,15H2/p+2