2-azanyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: 2-azanyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-fluoranyl-benzenesulfonamide Openeye Name: 2-amino-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-fluoro-benzenesulfonamide CAS Name: 2-amino-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-fluorobenzenesulfonamide IUPAC Name: 2-amino-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-fluorobenzenesulfonamide Traditional Name: 2-amino-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-fluoro-benzenesulfonamide Formula: C13H21FN3O2S+ MolecularWeight: 302.388143

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNS(=O)(=O)C2=C(C=C(C=C2)F)N

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNS(=O)(=O)C2=C(C=C(C=C2)F)N

InChI

InChI=1S/C13H20FN3O2S/c1-2-17-7-3-4-11(17)9-16-20(18,19)13-6-5-10(14)8-12(13)15/h5-6,8,11,16H,2-4,7,9,15H2,1H3/p+1/t11-/m0/s1