sodium (2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate hydrate

Systemtic Name: sodium (2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate hydrate Openeye Name: sodium (2S)-2-amino-4-hydroxy-4-oxo-butanoate hydrate CAS Name: sodium (2S)-2-amino-4-hydroxy-4-oxobutanoate hydrate IUPAC Name: sodium (2S)-2-amino-4-hydroxy-4-oxobutanoate hydrate Traditional Name: sodium (2S)-2-amino-4-hydroxy-4-keto-butyrate hydrate Formula: C4H8NNaO5 MolecularWeight: 173.09979

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H7NO4.Na.H2O/c5-2(4(8)9)1-3(6)7;;/h2H,1,5H2,(H,6,7)(H,8,9);;1H2/q;+1;/p-1/t2-;;/m0../s1