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

Systemtic Name: 4-bromanyl-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Openeye Name: 4-bromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide CAS Name: 4-bromo-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Traditional Name: 4-bromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Formula: C13H20BrN2O2S+ MolecularWeight: 348.2791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrN2O2S/c1-2-16-9-3-4-12(16)10-15-19(17,18)13-7-5-11(14)6-8-13/h5-8,12,15H,2-4,9-10H2,1H3/p+1/t12-/m0/s1