N-[[(3S)-piperidin-1-ium-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[(3S)-3-piperidin-1-iumyl]methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C13H18F3N2O2S+ MolecularWeight: 323.35443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)CNS(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)CNS(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H17F3N2O2S/c14-13(15,16)11-5-1-2-6-12(11)21(19,20)18-9-10-4-3-7-17-8-10/h1-2,5-6,10,17-18H,3-4,7-9H2/p+1/t10-/m0/s1