[(3S)-piperidin-1-ium-3-yl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide

Systemtic Name: [(3S)-piperidin-1-ium-3-yl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide Openeye Name: [(3S)-piperidin-1-ium-3-yl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide CAS Name: [(3S)-3-piperidin-1-iumyl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide IUPAC Name: [(3S)-piperidin-1-ium-3-yl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide Traditional Name: [(3S)-piperidin-1-ium-3-yl]sulfonyl-[3-(trifluoromethyl)phenyl]azanide Formula: C12H15F3N2O2S MolecularWeight: 308.31991

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)S(=O)(=O)[N-]C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)S(=O)(=O)[N-]C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C12H14F3N2O2S/c13-12(14,15)9-3-1-4-10(7-9)17-20(18,19)11-5-2-6-16-8-11/h1,3-4,7,11,16H,2,5-6,8H2/q-1/p+1/t11-/m0/s1