(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: (2S)-2-methyl-3-(1-piperazin-4-iumylsulfonyl)-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-1-pyrrolidino-propan-1-one Formula: C12H24N3O3S+ MolecularWeight: 290.40226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)N2CCCC2

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CC[NH2+]CC1)C(=O)N2CCCC2

InChI

InChI=1S/C12H23N3O3S/c1-11(12(16)14-6-2-3-7-14)10-19(17,18)15-8-4-13-5-9-15/h11,13H,2-10H2,1H3/p+1/t11-/m1/s1