sodium 2-(2-bromanylpropanoylamino)ethanesulfonate

Systemtic Name: sodium 2-(2-bromanylpropanoylamino)ethanesulfonate Openeye Name: sodium 2-(2-bromopropanoylamino)ethanesulfonate CAS Name: sodium 2-[(2-bromo-1-oxopropyl)amino]ethanesulfonate IUPAC Name: sodium 2-(2-bromopropanoylamino)ethanesulfonate Traditional Name: sodium 2-(2-bromopropanoylamino)ethanesulfonate Formula: C5H9BrNNaO4S MolecularWeight: 282.08803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS(=O)(=O)[O-])Br.[Na+]

Isomeric SMILES

CC(C(=O)NCCS(=O)(=O)[O-])Br.[Na+]

InChI

InChI=1S/C5H10BrNO4S.Na/c1-4(6)5(8)7-2-3-12(9,10)11;/h4H,2-3H2,1H3,(H,7,8)(H,9,10,11);/q;+1/p-1