1-methylsulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine

Systemtic Name: 1-methylsulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Openeye Name: 1-methylsulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine CAS Name: 1-methylsulfonyl-4-[3-(trifluoromethyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-methylsulfonyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Traditional Name: 1-mesyl-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine Formula: C11H15F3N3O2S+ MolecularWeight: 310.31591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14F3N3O2S/c1-20(18,19)17-7-5-16(6-8-17)10-9(11(12,13)14)3-2-4-15-10/h2-4H,5-8H2,1H3/p+1