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1-[1-(aminomethyl)-2-[3-(trifluoromethyl)phenyl]carbonyl-piperidin-1-ium-1-yl]-2-azanyl-ethanone

1-[1-(aminomethyl)-2-[3-(trifluoromethyl)phenyl]carbonyl-piperidin-1-ium-1-yl]-2-azanyl-ethanone

Systemtic Name:1-[1-(aminomethyl)-2-[3-(trifluoromethyl)phenyl]carbonyl-piperidin-1-ium-1-yl]-2-azanyl-ethanone
Openeye Name:2-amino-1-[1-(aminomethyl)-2-[3-(trifluoromethyl)benzoyl]piperidin-1-ium-1-yl]ethanone
CAS Name:2-amino-1-[1-(aminomethyl)-2-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperidin-1-iumyl]ethanone
IUPAC Name:2-amino-1-[1-(aminomethyl)-2-[3-(trifluoromethyl)benzoyl]piperidin-1-ium-1-yl]ethanone
Traditional Name:2-amino-1-[1-(aminomethyl)-2-[3-(trifluoromethyl)benzoyl]piperidin-1-ium-1-yl]ethanone
Formula: C16H21F3N3O2+
MolecularWeight: 344.35205
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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C(C1)C(=O)C2=CC(=CC=C2)C(F)(F)F)(CN)C(=O)CN


Isomeric SMILES

C1CC[N+](C(C1)C(=O)C2=CC(=CC=C2)C(F)(F)F)(CN)C(=O)CN


InChI

InChI=1S/C16H21F3N3O2/c17-16(18,19)12-5-3-4-11(8-12)15(24)13-6-1-2-7-22(13,10-21)14(23)9-20/h3-5,8,13H,1-2,6-7,9-10,20-21H2/q+1


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