1-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium

Systemtic Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Openeye Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium CAS Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Traditional Name: 1-[3-(trifluoromethyl)benzyl]piperazine-1,4-diium Formula: C12H17F3N2+2 MolecularWeight: 246.27199

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC2=CC(=CC=C2)C(F)(F)F

InChI

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