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

Systemtic Name: 1-phenyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Openeye Name: 1-phenyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-4-ium CAS Name: 1-phenyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-phenyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Traditional Name: 1-phenyl-4-[4-(trifluoromethyl)benzyl]piperazin-4-ium Formula: C18H20F3N2+ MolecularWeight: 321.36001

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C18H19F3N2/c19-18(20,21)16-8-6-15(7-9-16)14-22-10-12-23(13-11-22)17-4-2-1-3-5-17/h1-9H,10-14H2/p+1