1-(3-chlorophenyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-[3-(trifluoromethyl)benzyl]piperazin-4-ium Formula: C18H19ClF3N2+ MolecularWeight: 355.80507

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClF3N2/c19-16-5-2-6-17(12-16)24-9-7-23(8-10-24)13-14-3-1-4-15(11-14)18(20,21)22/h1-6,11-12H,7-10,13H2/p+1