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

Systemtic Name: 2-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Openeye Name: 2-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide CAS Name: 2-cyano-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 2-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Traditional Name: 2-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzenesulfonamide Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNS(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNS(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C14H19N3O2S/c1-2-17-9-5-7-13(17)11-16-20(18,19)14-8-4-3-6-12(14)10-15/h3-4,6,8,13,16H,2,5,7,9,11H2,1H3/p+1/t13-/m0/s1