2-piperazine-1,4-diium-1-ylethanesulfonate

Systemtic Name: 2-piperazine-1,4-diium-1-ylethanesulfonate Openeye Name: 2-piperazine-1,4-diium-1-ylethanesulfonate CAS Name: 2-(1-piperazine-1,4-diiumyl)ethanesulfonate IUPAC Name: 2-piperazine-1,4-diium-1-ylethanesulfonate Traditional Name: 2-piperazine-1,4-diium-1-ylethanesulfonate Formula: C6H15N2O3S+ MolecularWeight: 195.2599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCS(=O)(=O)[O-]

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCS(=O)(=O)[O-]

InChI

InChI=1S/C6H14N2O3S/c9-12(10,11)6-5-8-3-1-7-2-4-8/h7H,1-6H2,(H,9,10,11)/p+1