1-(3-methyl-5-nitro-imidazol-3-ium-1-yl)propan-2-one

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-3-ium-1-yl)propan-2-one Openeye Name: 1-(3-methyl-5-nitro-imidazol-3-ium-1-yl)propan-2-one CAS Name: 1-(3-methyl-5-nitro-1-imidazol-3-iumyl)-2-propanone IUPAC Name: 1-(3-methyl-5-nitroimidazol-3-ium-1-yl)propan-2-one Traditional Name: 1-(3-methyl-5-nitro-imidazol-3-ium-1-yl)acetone Formula: C7H10N3O3+ MolecularWeight: 184.1726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C=[N+](C=C1[N+](=O)[O-])C

Isomeric SMILES

CC(=O)CN1C=[N+](C=C1[N+](=O)[O-])C

InChI

InChI=1S/C7H10N3O3/c1-6(11)3-9-5-8(2)4-7(9)10(12)13/h4-5H,3H2,1-2H3/q+1