1-[4-(5-azanylpyridin-1-ium-2-yl)piperazin-1-yl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[4-(5-azanylpyridin-1-ium-2-yl)piperazin-1-yl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[4-(5-aminopyridin-1-ium-2-yl)piperazin-1-yl]-2,2,2-trifluoro-ethanone CAS Name: 1-[4-(5-amino-2-pyridin-1-iumyl)-1-piperazinyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[4-(5-aminopyridin-1-ium-2-yl)piperazin-1-yl]-2,2,2-trifluoroethanone Traditional Name: 1-[4-(5-aminopyridin-1-ium-2-yl)piperazino]-2,2,2-trifluoro-ethanone Formula: C11H14F3N4O+ MolecularWeight: 275.25027

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)N)C(=O)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)N)C(=O)C(F)(F)F

InChI

InChI=1S/C11H13F3N4O/c12-11(13,14)10(19)18-5-3-17(4-6-18)9-2-1-8(15)7-16-9/h1-2,7H,3-6,15H2/p+1