1-methyl-4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazin-1-ium Openeye Name: 1-methyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-ium CAS Name: 1-methyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-ium Traditional Name: 1-methyl-4-[4-(trifluoromethoxy)benzyl]piperazin-1-ium Formula: C13H18F3N2O+ MolecularWeight: 275.29003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17F3N2O/c1-17-6-8-18(9-7-17)10-11-2-4-12(5-3-11)19-13(14,15)16/h2-5H,6-10H2,1H3/p+1