sodium 3,3-dideuterio-2-oxidanylidene-butanoate

Systemtic Name: sodium 3,3-dideuterio-2-oxidanylidene-butanoate Openeye Name: sodium 3,3-dideuterio-2-oxo-butanoate CAS Name: sodium 3,3-dideuterio-2-oxobutanoate IUPAC Name: sodium 3,3-dideuterio-2-oxobutanoate Traditional Name: sodium 3,3-dideuterio-2-keto-butyrate Formula: C4H5NaO3 MolecularWeight: 126.082794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])(C)C(=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C4H6O3.Na/c1-2-3(5)4(6)7;/h2H2,1H3,(H,6,7);/q;+1/p-1/i2D2;