sodium 2-[[3-(methylsulfonylamino)-2-oxidanyl-propanoyl]amino]ethanesulfonate

Systemtic Name: sodium 2-[[3-(methylsulfonylamino)-2-oxidanyl-propanoyl]amino]ethanesulfonate Openeye Name: sodium 2-[[2-hydroxy-3-(methanesulfonamido)propanoyl]amino]ethanesulfonate CAS Name: sodium 2-[[2-hydroxy-3-(methanesulfonamido)-1-oxopropyl]amino]ethanesulfonate IUPAC Name: sodium 2-[[2-hydroxy-3-(methanesulfonamido)propanoyl]amino]ethanesulfonate Traditional Name: sodium 2-[[2-hydroxy-3-(methanesulfonamido)propanoyl]amino]ethanesulfonate Formula: C6H13N2NaO7S2 MolecularWeight: 312.29639

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC(C(=O)NCCS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CS(=O)(=O)NCC(C(=O)NCCS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C6H14N2O7S2.Na/c1-16(11,12)8-4-5(9)6(10)7-2-3-17(13,14)15;/h5,8-9H,2-4H2,1H3,(H,7,10)(H,13,14,15);/q;+1/p-1