N-[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]-1-(1-methyl-5-nitro-imidazol-2-yl)methanimine oxide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]-1-(1-methyl-5-nitro-imidazol-2-yl)methanimine oxide Openeye Name: N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-(1-methyl-5-nitro-imidazol-2-yl)methanimine oxide CAS Name: N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-(1-methyl-5-nitro-2-imidazolyl)methanimine oxide IUPAC Name: N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide Traditional Name: N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-(1-methyl-5-nitro-imidazol-2-yl)methanimine oxide Formula: C14H16N4O5 MolecularWeight: 320.30064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C=[N+](CC(C2=CC=C(C=C2)OC)O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1/C=[N+](/CC(C2=CC=C(C=C2)OC)O)\[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O5/c1-16-13(15-7-14(16)18(21)22)9-17(20)8-12(19)10-3-5-11(23-2)6-4-10/h3-7,9,12,19H,8H2,1-2H3/b17-9-