ethyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)ethanoate

Systemtic Name: ethyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)ethanoate Openeye Name: ethyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetate CAS Name: 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetate Traditional Name: 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetic acid ethyl ester Formula: C8H12N3O4+ MolecularWeight: 214.19858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(NC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C[N+]1=C(NC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C8H11N3O4/c1-3-15-8(12)5-10-4-7(11(13)14)9-6(10)2/h4H,3,5H2,1-2H3/p+1