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

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-propyl-benzenesulfonamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-propyl-benzenesulfonamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-propylbenzenesulfonamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-propylbenzenesulfonamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-propyl-benzenesulfonamide Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NCC2CCC[NH+]2CC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC[C@@H]2CCC[NH+]2CC

InChI

InChI=1S/C16H26N2O2S/c1-3-6-14-8-10-16(11-9-14)21(19,20)17-13-15-7-5-12-18(15)4-2/h8-11,15,17H,3-7,12-13H2,1-2H3/p+1/t15-/m0/s1