sodium 3-(3-cyano-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl)propanoate

Systemtic Name: sodium 3-(3-cyano-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl)propanoate Openeye Name: sodium 3-(3-cyano-4-hydroxy-5-oxo-2H-pyrrol-1-yl)propanoate CAS Name: sodium 3-(3-cyano-4-hydroxy-5-oxo-2H-pyrrol-1-yl)propanoate IUPAC Name: sodium 3-(3-cyano-4-hydroxy-5-oxo-2H-pyrrol-1-yl)propanoate Traditional Name: sodium 3-(4-cyano-3-hydroxy-2-keto-3-pyrrolin-1-yl)propionate Formula: C8H7N2NaO4 MolecularWeight: 218.14195

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(=O)N1CCC(=O)[O-])O)C#N.[Na+]

Isomeric SMILES

C1C(=C(C(=O)N1CCC(=O)[O-])O)C#N.[Na+]

InChI

InChI=1S/C8H8N2O4.Na/c9-3-5-4-10(2-1-6(11)12)8(14)7(5)13;/h13H,1-2,4H2,(H,11,12);/q;+1/p-1