4-(5-iodanyl-2-methyl-4-nitro-imidazol-1-yl)butan-2-one

Systemtic Name: 4-(5-iodanyl-2-methyl-4-nitro-imidazol-1-yl)butan-2-one Openeye Name: 4-(5-iodo-2-methyl-4-nitro-imidazol-1-yl)butan-2-one CAS Name: 4-(5-iodo-2-methyl-4-nitro-1-imidazolyl)-2-butanone IUPAC Name: 4-(5-iodo-2-methyl-4-nitroimidazol-1-yl)butan-2-one Traditional Name: 4-(5-iodo-2-methyl-4-nitro-imidazol-1-yl)butan-2-one Formula: C8H10IN3O3 MolecularWeight: 323.08777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CCC(=O)C)I)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CCC(=O)C)I)[N+](=O)[O-]

InChI

InChI=1S/C8H10IN3O3/c1-5(13)3-4-11-6(2)10-8(7(11)9)12(14)15/h3-4H2,1-2H3