1-ethyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium

Systemtic Name: 1-ethyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium Openeye Name: 1-ethyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium CAS Name: 1-ethyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium IUPAC Name: 1-ethyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium Traditional Name: 1-ethyl-4-[2-(trifluoromethyl)benzyl]piperazin-1-ium Formula: C14H20F3N2+ MolecularWeight: 273.31721

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H19F3N2/c1-2-18-7-9-19(10-8-18)11-12-5-3-4-6-13(12)14(15,16)17/h3-6H,2,7-11H2,1H3/p+1