methyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)ethanoate

Systemtic Name: methyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)ethanoate Openeye Name: methyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetate CAS Name: 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetate Traditional Name: 2-(2-methyl-5-nitro-1H-imidazol-3-ium-3-yl)acetic acid methyl ester Formula: C7H10N3O4+ MolecularWeight: 200.172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(N1)[N+](=O)[O-])CC(=O)OC

Isomeric SMILES

CC1=[N+](C=C(N1)[N+](=O)[O-])CC(=O)OC

InChI

InChI=1S/C7H9N3O4/c1-5-8-6(10(12)13)3-9(5)4-7(11)14-2/h3H,4H2,1-2H3/p+1