2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(4-fluoranyl-3-nitro-phenyl)ethanone

Systemtic Name: 2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(4-fluoranyl-3-nitro-phenyl)ethanone Openeye Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-fluoro-3-nitro-phenyl)ethanone CAS Name: 2-(5-bromo-2-methyl-4-nitro-1-imidazolyl)-1-(4-fluoro-3-nitrophenyl)ethanone IUPAC Name: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(4-fluoro-3-nitrophenyl)ethanone Traditional Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-fluoro-3-nitro-phenyl)ethanone Formula: C12H8BrFN4O5 MolecularWeight: 387.118123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C12H8BrFN4O5/c1-6-15-12(18(22)23)11(13)16(6)5-10(19)7-2-3-8(14)9(4-7)17(20)21/h2-4H,5H2,1H3