sodium (2S)-2-azanyl-3-(5-oxidanylidene-2H-1,2-oxazol-4-yl)propanoate

Systemtic Name: sodium (2S)-2-azanyl-3-(5-oxidanylidene-2H-1,2-oxazol-4-yl)propanoate Openeye Name: sodium (2S)-2-amino-3-(5-oxo-2H-isoxazol-4-yl)propanoate CAS Name: sodium (2S)-2-amino-3-(5-oxo-2H-isoxazol-4-yl)propanoate IUPAC Name: sodium (2S)-2-amino-3-(5-oxo-2H-1,2-oxazol-4-yl)propanoate Traditional Name: sodium (2S)-2-amino-3-(5-keto-3-isoxazolin-4-yl)propionate Formula: C6H7N2NaO4 MolecularWeight: 194.12055

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)ON1)CC(C(=O)[O-])N.[Na+]

Isomeric SMILES

C1=C(C(=O)ON1)C[C@@H](C(=O)[O-])N.[Na+]

InChI

InChI=1S/C6H8N2O4.Na/c7-4(5(9)10)1-3-2-8-12-6(3)11;/h2,4,8H,1,7H2,(H,9,10);/q;+1/p-1/t4-;/m0./s1