1-[[(2S)-1-butylsulfonylpyrrolidin-2-yl]methyl]piperazin-4-ium

Systemtic Name: 1-[[(2S)-1-butylsulfonylpyrrolidin-2-yl]methyl]piperazin-4-ium Openeye Name: 1-[[(2S)-1-butylsulfonylpyrrolidin-2-yl]methyl]piperazin-4-ium CAS Name: 1-[[(2S)-1-butylsulfonyl-2-pyrrolidinyl]methyl]piperazin-4-ium IUPAC Name: 1-[[(2S)-1-butylsulfonylpyrrolidin-2-yl]methyl]piperazin-4-ium Traditional Name: 1-[[(2S)-1-butylsulfonylpyrrolidin-2-yl]methyl]piperazin-4-ium Formula: C13H28N3O2S+ MolecularWeight: 290.44532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCC1CN2CC[NH2+]CC2

Isomeric SMILES

CCCCS(=O)(=O)N1CCC[C@H]1CN2CC[NH2+]CC2

InChI

InChI=1S/C13H27N3O2S/c1-2-3-11-19(17,18)16-8-4-5-13(16)12-15-9-6-14-7-10-15/h13-14H,2-12H2,1H3/p+1/t13-/m0/s1