2-(5-ethyl-2-nitro-imidazol-1-yl)ethanoic acid

Systemtic Name: 2-(5-ethyl-2-nitro-imidazol-1-yl)ethanoic acid Openeye Name: 2-(5-ethyl-2-nitro-imidazol-1-yl)acetic acid CAS Name: 2-(5-ethyl-2-nitro-1-imidazolyl)acetic acid IUPAC Name: 2-(5-ethyl-2-nitroimidazol-1-yl)acetic acid Traditional Name: 2-(5-ethyl-2-nitro-imidazol-1-yl)acetic acid Formula: C7H9N3O4 MolecularWeight: 199.16406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N1CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCC1=CN=C(N1CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-2-5-3-8-7(10(13)14)9(5)4-6(11)12/h3H,2,4H2,1H3,(H,11,12)