methyl 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propanoate

Systemtic Name: methyl 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propanoate Openeye Name: methyl 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propanoate CAS Name: 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propanoate Traditional Name: 2-acetamido-3-(4-nitro-1H-imidazol-5-yl)propionic acid methyl ester Formula: C9H12N4O5 MolecularWeight: 256.21538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(N=CN1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=C(N=CN1)[N+](=O)[O-])C(=O)OC

InChI

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