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2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]propan-1-one

2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]propan-1-one

Systemtic Name:2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]propan-1-one
Openeye Name:2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]propan-1-one
CAS Name:2-methyl-1-[4-[3-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]-1-propanone
IUPAC Name:2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]propan-1-one
Traditional Name:2-methyl-1-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]propan-1-one
Formula: C14H19F3N3O+
MolecularWeight: 302.31537
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=[NH+]2)C(F)(F)F


Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=[NH+]2)C(F)(F)F


InChI

InChI=1S/C14H18F3N3O/c1-10(2)13(21)20-8-6-19(7-9-20)12-11(14(15,16)17)4-3-5-18-12/h3-5,10H,6-9H2,1-2H3/p+1


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