sodium 2-(1H-imidazol-5-yl)ethanoate hydrate

Systemtic Name: sodium 2-(1H-imidazol-5-yl)ethanoate hydrate Openeye Name: sodium 2-(1H-imidazol-5-yl)acetate hydrate CAS Name: sodium 2-(1H-imidazol-5-yl)acetate hydrate IUPAC Name: sodium 2-(1H-imidazol-5-yl)acetate hydrate Traditional Name: sodium 2-(1H-imidazol-5-yl)acetate hydrate Formula: C5H7N2NaO3 MolecularWeight: 166.11045

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(=O)[O-].O.[Na+]

Isomeric SMILES

C1=C(NC=N1)CC(=O)[O-].O.[Na+]

InChI

InChI=1S/C5H6N2O2.Na.H2O/c8-5(9)1-4-2-6-3-7-4;;/h2-3H,1H2,(H,6,7)(H,8,9);;1H2/q;+1;/p-1