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

Systemtic Name: 1-methyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[4-(trifluoromethyl)benzyl]piperazine-1,4-diium Formula: C13H19F3N2+2 MolecularWeight: 260.29857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17F3N2/c1-17-6-8-18(9-7-17)10-11-2-4-12(5-3-11)13(14,15)16/h2-5H,6-10H2,1H3/p+2