sodium 3-methyl-1-oxidanyl-1-oxidanylidene-2-(2-sulfonatosulfanylethanoylamino)pentane

Systemtic Name: sodium 3-methyl-1-oxidanyl-1-oxidanylidene-2-(2-sulfonatosulfanylethanoylamino)pentane Openeye Name: sodium 1-hydroxy-3-methyl-1-oxo-2-[(2-sulfonatosulfanylacetyl)amino]pentane CAS Name: sodium 1-hydroxy-3-methyl-1-oxo-2-[[1-oxo-2-(sulfonatothio)ethyl]amino]pentane IUPAC Name: sodium 1-hydroxy-3-methyl-1-oxo-2-[(2-sulfonatosulfanylacetyl)amino]pentane Traditional Name: sodium 1-hydroxy-1-keto-3-methyl-2-[[2-(sulfonatothio)acetyl]amino]pentane Formula: C8H14NNaO6S2 MolecularWeight: 307.31963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO6S2.Na/c1-3-5(2)7(8(11)12)9-6(10)4-16-17(13,14)15;/h5,7H,3-4H2,1-2H3,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1