2-[(2E)-2-[azanyl(nitroso)methylidene]-4-nitro-1H-imidazol-3-yl]ethyl ethanoate

Systemtic Name: 2-[(2E)-2-[azanyl(nitroso)methylidene]-4-nitro-1H-imidazol-3-yl]ethyl ethanoate Openeye Name: 2-[(2E)-2-[amino(nitroso)methylene]-4-nitro-1H-imidazol-3-yl]ethyl acetate CAS Name: acetic acid 2-[(2E)-2-[amino(nitroso)methylidene]-4-nitro-1H-imidazol-3-yl]ethyl ester IUPAC Name: 2-[(2E)-2-[amino(nitroso)methylidene]-4-nitro-1H-imidazol-3-yl]ethyl acetate Traditional Name: acetic acid 2-[(2E)-2-[amino(nitroso)methylene]-5-nitro-4-imidazolin-1-yl]ethyl ester Formula: C8H11N5O5 MolecularWeight: 257.20344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C(=CNC1=C(N)N=O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCN\1C(=CN/C1=C(/N)\N=O)[N+](=O)[O-]

InChI

InChI=1S/C8H11N5O5/c1-5(14)18-3-2-12-6(13(16)17)4-10-8(12)7(9)11-15/h4,10H,2-3,9H2,1H3/b8-7+