sodium 5-oxidanylidenepyrrolidine-2-carboxylate trihydrate

Systemtic Name: sodium 5-oxidanylidenepyrrolidine-2-carboxylate trihydrate Openeye Name: sodium 5-oxopyrrolidine-2-carboxylate trihydrate CAS Name: sodium 5-oxo-2-pyrrolidinecarboxylate trihydrate IUPAC Name: sodium 5-oxopyrrolidine-2-carboxylate trihydrate Traditional Name: sodium pyroglutamate trihydrate Formula: C5H12NNaO6 MolecularWeight: 205.14165

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)[O-].O.O.O.[Na+]

Isomeric SMILES

C1CC(=O)NC1C(=O)[O-].O.O.O.[Na+]

InChI

InChI=1S/C5H7NO3.Na.3H2O/c7-4-2-1-3(6-4)5(8)9;;;;/h3H,1-2H2,(H,6,7)(H,8,9);;3*1H2/q;+1;;;/p-1