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

Systemtic Name: 2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(3-nitrophenyl)ethanone Openeye Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(3-nitrophenyl)ethanone CAS Name: 2-(5-bromo-2-methyl-4-nitro-1-imidazolyl)-1-(3-nitrophenyl)ethanone IUPAC Name: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(3-nitrophenyl)ethanone Traditional Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(3-nitrophenyl)ethanone Formula: C12H9BrN4O5 MolecularWeight: 369.12766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9BrN4O5/c1-7-14-12(17(21)22)11(13)15(7)6-10(18)8-3-2-4-9(5-8)16(19)20/h2-5H,6H2,1H3