1-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]pentan-1-one

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]pentan-1-one Openeye Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]pentan-1-one CAS Name: 1-[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-1-pentanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]pentan-1-one Traditional Name: 1-[4-(4-fluorobenzyl)piperazin-4-ium-1-yl]pentan-1-one Formula: C16H24FN2O+ MolecularWeight: 279.372963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCC(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H23FN2O/c1-2-3-4-16(20)19-11-9-18(10-12-19)13-14-5-7-15(17)8-6-14/h5-8H,2-4,9-13H2,1H3/p+1