1-methyl-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]piperazin-1-ium Openeye Name: 1-methyl-4-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidyl]piperazin-1-ium CAS Name: 1-methyl-4-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]piperazin-1-ium Traditional Name: 1-methyl-4-[1-[2-(trifluoromethyl)benzyl]-4-piperidyl]piperazin-1-ium Formula: C18H27F3N3+ MolecularWeight: 342.42229

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CCN(CC2)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2CCN(CC2)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H26F3N3/c1-22-10-12-24(13-11-22)16-6-8-23(9-7-16)14-15-4-2-3-5-17(15)18(19,20)21/h2-5,16H,6-14H2,1H3/p+1