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

Systemtic Name: 1-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Openeye Name: 1-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium CAS Name: 1-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Traditional Name: 1-[2-(trifluoromethyl)benzyl]piperazin-4-ium Formula: C12H16F3N2+ MolecularWeight: 245.26405

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C12H15F3N2/c13-12(14,15)11-4-2-1-3-10(11)9-17-7-5-16-6-8-17/h1-4,16H,5-9H2/p+1