1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-4-ium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-4-ium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-4-ium; 2,2,2-trifluoroacetate CAS Name: 1-[(1-pyridin-4-yl-4-piperidinyl)methyl]piperazin-4-ium; 2,2,2-trifluoroacetate IUPAC Name: 1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-4-ium; 2,2,2-trifluoroacetate Traditional Name: 1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-4-ium; 2,2,2-trifluoroacetate Formula: C17H25F3N4O2 MolecularWeight: 374.40121

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC[NH2+]CC2)C3=CC=NC=C3.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1CN(CCC1CN2CC[NH2+]CC2)C3=CC=NC=C3.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C15H24N4.C2HF3O2/c1-5-16-6-2-15(1)19-9-3-14(4-10-19)13-18-11-7-17-8-12-18;3-2(4,5)1(6)7/h1-2,5-6,14,17H,3-4,7-13H2;(H,6,7)