1-(4-fluorophenyl)-4-[[(2S)-oxiran-2-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)-4-[[(2S)-oxiran-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)-4-[[(2S)-oxiran-2-yl]methyl]piperazin-4-ium CAS Name: 1-(4-fluorophenyl)-4-[[(2S)-2-oxiranyl]methyl]piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)-4-[[(2S)-oxiran-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)-4-[[(2S)-oxiran-2-yl]methyl]piperazin-4-ium Formula: C13H18FN2O+ MolecularWeight: 237.293223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2CO2)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1C[C@H]2CO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C13H17FN2O/c14-11-1-3-12(4-2-11)16-7-5-15(6-8-16)9-13-10-17-13/h1-4,13H,5-10H2/p+1/t13-/m0/s1