1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[(2,5-difluorophenyl)methyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[(2,5-difluorophenyl)methyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[(2,5-difluorophenyl)methyl]-4-ethylpiperazin-4-ium Traditional Name: 1-(2,5-difluorobenzyl)-4-ethyl-piperazin-4-ium Formula: C13H19F2N2+ MolecularWeight: 241.300166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(C=CC(=C2)F)F

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(C=CC(=C2)F)F

InChI

InChI=1S/C13H18F2N2/c1-2-16-5-7-17(8-6-16)10-11-9-12(14)3-4-13(11)15/h3-4,9H,2,5-8,10H2,1H3/p+1