dimethyl-[2-[[(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propanoyl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propanoyl]amino]ethyl]azanium Openeye Name: dimethyl-[2-[[(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propanoyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[(2S)-2-methyl-1-oxo-3-(1-piperazin-4-iumylsulfonyl)propyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonylpropanoyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[(2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propanoyl]amino]ethyl]ammonium Formula: C12H28N4O3S+2 MolecularWeight: 308.44072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H26N4O3S/c1-11(12(17)14-6-7-15(2)3)10-20(18,19)16-8-4-13-5-9-16/h11,13H,4-10H2,1-3H3,(H,14,17)/p+2/t11-/m1/s1