1-[(4-fluorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium

Systemtic Name: 1-[(4-fluorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Openeye Name: 1-[(4-fluorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium CAS Name: 1-[(4-fluorophenyl)methyl]-4-[[(2R)-2-pyrrolidin-1-iumyl]methyl]piperazin-1-ium IUPAC Name: 1-[(4-fluorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Traditional Name: 1-(4-fluorobenzyl)-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Formula: C16H26FN3+2 MolecularWeight: 279.396143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1C[C@@H]([NH2+]C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C16H24FN3/c17-15-5-3-14(4-6-15)12-19-8-10-20(11-9-19)13-16-2-1-7-18-16/h3-6,16,18H,1-2,7-13H2/p+2/t16-/m1/s1