2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(2,5-dimethylphenyl)ethanone

Systemtic Name: 2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(2,5-dimethylphenyl)ethanone Openeye Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(2,5-dimethylphenyl)ethanone CAS Name: 2-(5-bromo-2-methyl-4-nitro-1-imidazolyl)-1-(2,5-dimethylphenyl)ethanone IUPAC Name: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(2,5-dimethylphenyl)ethanone Traditional Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(2,5-dimethylphenyl)ethanone Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CN2C(=NC(=C2Br)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CN2C(=NC(=C2Br)[N+](=O)[O-])C

InChI

InChI=1S/C14H14BrN3O3/c1-8-4-5-9(2)11(6-8)12(19)7-17-10(3)16-14(13(17)15)18(20)21/h4-6H,7H2,1-3H3