1-[5-methyl-2-nitro-1-(2-oxidanylpropyl)imidazol-4-yl]ethanone

Systemtic Name: 1-[5-methyl-2-nitro-1-(2-oxidanylpropyl)imidazol-4-yl]ethanone Openeye Name: 1-[1-(2-hydroxypropyl)-5-methyl-2-nitro-imidazol-4-yl]ethanone CAS Name: 1-[1-(2-hydroxypropyl)-5-methyl-2-nitro-4-imidazolyl]ethanone IUPAC Name: 1-[1-(2-hydroxypropyl)-5-methyl-2-nitroimidazol-4-yl]ethanone Traditional Name: 1-[1-(2-hydroxypropyl)-5-methyl-2-nitro-imidazol-4-yl]ethanone Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1CC(C)O)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(N=C(N1CC(C)O)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C9H13N3O4/c1-5(13)4-11-6(2)8(7(3)14)10-9(11)12(15)16/h5,13H,4H2,1-3H3