ethyl 2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)-3-oxo-butanoate CAS Name: 2-(3-ethyl-2-methyl-5-nitro-4-imidazolyl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(3-ethyl-2-methyl-5-nitroimidazol-4-yl)-3-oxobutanoate Traditional Name: 2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)-3-keto-butyric acid ethyl ester Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1C(C(=O)C)C(=O)OCC)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NC(=C1C(C(=O)C)C(=O)OCC)[N+](=O)[O-])C

InChI

InChI=1S/C12H17N3O5/c1-5-14-8(4)13-11(15(18)19)10(14)9(7(3)16)12(17)20-6-2/h9H,5-6H2,1-4H3