4-[(1R)-1-[[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[(1R)-1-[[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[(1R)-1-[[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[(1R)-1-[[5-(trifluoromethyl)-2-pyridin-1-iumyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[(1R)-1-[[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[(1R)-1-[[5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]ethyl]benzenesulfonamide Formula: C14H15F3N3O2S+ MolecularWeight: 346.34801

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC2=[NH+]C=C(C=C2)C(F)(F)F

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)S(=O)(=O)N)NC2=[NH+]C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H14F3N3O2S/c1-9(10-2-5-12(6-3-10)23(18,21)22)20-13-7-4-11(8-19-13)14(15,16)17/h2-9H,1H3,(H,19,20)(H2,18,21,22)/p+1/t9-/m1/s1