1-(5-cyano-1-methyl-4-nitro-imidazol-2-yl)ethyl ethanoate

Systemtic Name: 1-(5-cyano-1-methyl-4-nitro-imidazol-2-yl)ethyl ethanoate Openeye Name: 1-(5-cyano-1-methyl-4-nitro-imidazol-2-yl)ethyl acetate CAS Name: acetic acid 1-(5-cyano-1-methyl-4-nitro-2-imidazolyl)ethyl ester IUPAC Name: 1-(5-cyano-1-methyl-4-nitroimidazol-2-yl)ethyl acetate Traditional Name: acetic acid 1-(5-cyano-1-methyl-4-nitro-imidazol-2-yl)ethyl ester Formula: C9H10N4O4 MolecularWeight: 238.2001

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=C(N1C)C#N)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC(C1=NC(=C(N1C)C#N)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C9H10N4O4/c1-5(17-6(2)14)8-11-9(13(15)16)7(4-10)12(8)3/h5H,1-3H3