1,4-bis[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium

Systemtic Name: 1,4-bis[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium Openeye Name: 1,4-bis[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium CAS Name: 1,4-bis[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium IUPAC Name: 1,4-bis[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium Traditional Name: 1,4-bis[2-(trifluoromethyl)benzyl]piperazin-1-ium Formula: C20H21F6N2+ MolecularWeight: 403.384559

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2C(F)(F)F)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2C(F)(F)F)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H20F6N2/c21-19(22,23)17-7-3-1-5-15(17)13-27-9-11-28(12-10-27)14-16-6-2-4-8-18(16)20(24,25)26/h1-8H,9-14H2/p+1