1-(3-methyl-2-nitro-imidazol-4-yl)-N-(2-oxidanylpropyl)methanimine oxide

Systemtic Name: 1-(3-methyl-2-nitro-imidazol-4-yl)-N-(2-oxidanylpropyl)methanimine oxide Openeye Name: N-(2-hydroxypropyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide CAS Name: N-(2-hydroxypropyl)-1-(3-methyl-2-nitro-4-imidazolyl)methanimine oxide IUPAC Name: N-(2-hydroxypropyl)-1-(3-methyl-2-nitroimidazol-4-yl)methanimine oxide Traditional Name: N-(2-hydroxypropyl)-1-(3-methyl-2-nitro-imidazol-4-yl)methanimine oxide Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+](=CC1=CN=C(N1C)[N+](=O)[O-])[O-])O

Isomeric SMILES

CC(C/[N+](=C\C1=CN=C(N1C)[N+](=O)[O-])/[O-])O

InChI

InChI=1S/C8H12N4O4/c1-6(13)4-11(14)5-7-3-9-8(10(7)2)12(15)16/h3,5-6,13H,4H2,1-2H3/b11-5+