2-(2-nitroimidazol-1-yl)ethanoic acid; sodium

Systemtic Name: 2-(2-nitroimidazol-1-yl)ethanoic acid; sodium Openeye Name: 2-(2-nitroimidazol-1-yl)acetic acid; sodium CAS Name: 2-(2-nitro-1-imidazolyl)acetic acid; sodium IUPAC Name: 2-(2-nitroimidazol-1-yl)acetic acid; sodium Traditional Name: 2-(2-nitroimidazol-1-yl)acetic acid; sodium Formula: C5H5N3NaO4 MolecularWeight: 194.10067

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H5N3O4.Na/c9-4(10)3-7-2-1-6-5(7)8(11)12;/h1-2H,3H2,(H,9,10);