N-(2-acetyloxyethyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide

Systemtic Name: N-(2-acetyloxyethyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide Openeye Name: N-(2-acetoxyethyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide CAS Name: N-(2-acetyloxyethyl)-1-(3-methyl-2-nitro-4-imidazolyl)methanimine oxide IUPAC Name: N-(2-acetyloxyethyl)-1-(3-methyl-2-nitroimidazol-4-yl)methanimine oxide Traditional Name: N-(2-acetoxyethyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide Formula: C9H12N4O5 MolecularWeight: 256.21538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[N+](=CC1=CN=C(N1C)[N+](=O)[O-])[O-]

Isomeric SMILES

CC(=O)OCC/[N+](=C/C1=CN=C(N1C)[N+](=O)[O-])/[O-]

InChI

InChI=1S/C9H12N4O5/c1-7(14)18-4-3-12(15)6-8-5-10-9(11(8)2)13(16)17/h5-6H,3-4H2,1-2H3/b12-6-