2-[4-(2-sulfonatoethyl)piperazin-1-ium-1-yl]ethanesulfonate

Systemtic Name: 2-[4-(2-sulfonatoethyl)piperazin-1-ium-1-yl]ethanesulfonate Openeye Name: 2-[4-(2-sulfonatoethyl)piperazin-1-ium-1-yl]ethanesulfonate CAS Name: 2-[4-(2-sulfonatoethyl)-1-piperazin-1-iumyl]ethanesulfonate IUPAC Name: 2-[4-(2-sulfonatoethyl)piperazin-1-ium-1-yl]ethanesulfonate Traditional Name: 2-[4-(2-sulfonatoethyl)piperazin-1-ium-1-yl]ethanesulfonate Formula: C8H17N2O6S2- MolecularWeight: 301.36038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCS(=O)(=O)[O-])CCS(=O)(=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CCS(=O)(=O)[O-])CCS(=O)(=O)[O-]

InChI

InChI=1S/C8H18N2O6S2/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16/h1-8H2,(H,11,12,13)(H,14,15,16)/p-1