sodium (2-methylbutanoylamino)methanesulfonate

Systemtic Name: sodium (2-methylbutanoylamino)methanesulfonate Openeye Name: sodium (2-methylbutanoylamino)methanesulfonate CAS Name: sodium [(2-methyl-1-oxobutyl)amino]methanesulfonate IUPAC Name: sodium (2-methylbutanoylamino)methanesulfonate Traditional Name: sodium (2-methylbutanoylamino)methanesulfonate Formula: C6H12NNaO4S MolecularWeight: 217.21855

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCC(C)C(=O)NCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H13NO4S.Na/c1-3-5(2)6(8)7-4-12(9,10)11;/h5H,3-4H2,1-2H3,(H,7,8)(H,9,10,11);/q;+1/p-1