(2R)-3-[4-[bis(azanyl)methylidene]piperazine-1,4-diium-1-yl]-2-oxidanyl-propane-1-sulfonate

Systemtic Name: (2R)-3-[4-[bis(azanyl)methylidene]piperazine-1,4-diium-1-yl]-2-oxidanyl-propane-1-sulfonate Openeye Name: (2R)-3-[4-(diaminomethylene)piperazine-1,4-diium-1-yl]-2-hydroxy-propane-1-sulfonate CAS Name: (2R)-3-[4-(diaminomethylidene)-1-piperazine-1,4-diiumyl]-2-hydroxy-1-propanesulfonate IUPAC Name: (2R)-3-[4-(diaminomethylidene)piperazine-1,4-diium-1-yl]-2-hydroxypropane-1-sulfonate Traditional Name: (2R)-3-[4-(diaminomethylene)piperazine-1,4-diium-1-yl]-2-hydroxy-propane-1-sulfonate Formula: C8H19N4O4S+ MolecularWeight: 267.32586

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(N)N)CC[NH+]1CC(CS(=O)(=O)[O-])O

Isomeric SMILES

C1C[N+](=C(N)N)CC[NH+]1C[C@H](CS(=O)(=O)[O-])O

InChI

InChI=1S/C8H18N4O4S/c9-8(10)12-3-1-11(2-4-12)5-7(13)6-17(14,15)16/h7,13H,1-6H2,(H4,9,10,14,15,16)/p+1/t7-/m1/s1