disodium 3-[(2R)-3-oxidanidyl-3-oxidanylidene-2-(2,2,2-trideuterioethanoylamino)propyl]sulfanylbutanoate

Systemtic Name: disodium 3-[(2R)-3-oxidanidyl-3-oxidanylidene-2-(2,2,2-trideuterioethanoylamino)propyl]sulfanylbutanoate Openeye Name: disodium 3-[(2R)-3-oxido-3-oxo-2-[(2,2,2-trideuterioacetyl)amino]propyl]sulfanylbutanoate CAS Name: disodium 3-[[(2R)-3-oxido-3-oxo-2-[(2,2,2-trideuterio-1-oxoethyl)amino]propyl]thio]butanoate IUPAC Name: disodium 3-[(2R)-3-oxido-3-oxo-2-[(2,2,2-trideuterioacetyl)amino]propyl]sulfanylbutanoate Traditional Name: disodium 3-[[(2R)-3-keto-3-oxido-2-[(2,2,2-trideuterioacetyl)amino]propyl]thio]butyrate Formula: C9H13NNa2O5S MolecularWeight: 296.266245

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)[O-])SCC(C(=O)[O-])NC(=O)C.[Na+].[Na+]

Isomeric SMILES

[2H]C([2H])([2H])C(=O)N[C@@H](CSC(C)CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C9H15NO5S.2Na/c1-5(3-8(12)13)16-4-7(9(14)15)10-6(2)11;;/h5,7H,3-4H2,1-2H3,(H,10,11)(H,12,13)(H,14,15);;/q;2*+1/p-2/t5?,7-;;/m0../s1/i2D3;;