ethyl 5-bromanyl-4-nitro-imidazole-1-carboxylate

Systemtic Name: ethyl 5-bromanyl-4-nitro-imidazole-1-carboxylate Openeye Name: ethyl 5-bromo-4-nitro-imidazole-1-carboxylate CAS Name: 5-bromo-4-nitro-1-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-4-nitroimidazole-1-carboxylate Traditional Name: 5-bromo-4-nitro-imidazole-1-carboxylic acid ethyl ester Formula: C6H6BrN3O4 MolecularWeight: 264.03354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=NC(=C1Br)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1C=NC(=C1Br)[N+](=O)[O-]

InChI

InChI=1S/C6H6BrN3O4/c1-2-14-6(11)9-3-8-5(4(9)7)10(12)13/h3H,2H2,1H3