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

Systemtic Name: ethyl 3-azanyl-2-(3-methyl-5-nitro-imidazol-4-yl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-amino-2-(3-methyl-5-nitro-imidazol-4-yl)-3-oxo-propanoate CAS Name: 3-amino-2-(3-methyl-5-nitro-4-imidazolyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-(3-methyl-5-nitroimidazol-4-yl)-3-oxopropanoate Traditional Name: 3-amino-3-keto-2-(3-methyl-5-nitro-imidazol-4-yl)propionic acid ethyl ester Formula: C9H12N4O5 MolecularWeight: 256.21538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N=CN1C)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CCOC(=O)C(C1=C(N=CN1C)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C9H12N4O5/c1-3-18-9(15)5(7(10)14)6-8(13(16)17)11-4-12(6)2/h4-5H,3H2,1-2H3,(H2,10,14)