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

Systemtic Name: 2-(5-bromanyl-2-methyl-4-nitro-imidazol-1-yl)-1-(4-methoxyphenyl)ethanone Openeye Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-methoxyphenyl)ethanone CAS Name: 2-(5-bromo-2-methyl-4-nitro-1-imidazolyl)-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-(5-bromo-2-methyl-4-nitroimidazol-1-yl)-1-(4-methoxyphenyl)ethanone Traditional Name: 2-(5-bromo-2-methyl-4-nitro-imidazol-1-yl)-1-(4-methoxyphenyl)ethanone Formula: C13H12BrN3O4 MolecularWeight: 354.15608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN3O4/c1-8-15-13(17(19)20)12(14)16(8)7-11(18)9-3-5-10(21-2)6-4-9/h3-6H,7H2,1-2H3