N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]methanesulfonamide

Systemtic Name: N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]methanesulfonamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]methanesulfonamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]amino]ethyl]methanesulfonamide IUPAC Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]methanesulfonamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]methanesulfonamide Formula: C9H12ClF3N3O2S+ MolecularWeight: 318.72369

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCNC1=C(C=C(C=[NH+]1)C(F)(F)F)Cl

Isomeric SMILES

CS(=O)(=O)NCCNC1=C(C=C(C=[NH+]1)C(F)(F)F)Cl

InChI

InChI=1S/C9H11ClF3N3O2S/c1-19(17,18)16-3-2-14-8-7(10)4-6(5-15-8)9(11,12)13/h4-5,16H,2-3H2,1H3,(H,14,15)/p+1