methyl 3-(4-nitroimidazol-1-yl)propanoate

Systemtic Name: methyl 3-(4-nitroimidazol-1-yl)propanoate Openeye Name: methyl 3-(4-nitroimidazol-1-yl)propanoate CAS Name: 3-(4-nitro-1-imidazolyl)propanoic acid methyl ester IUPAC Name: methyl 3-(4-nitroimidazol-1-yl)propanoate Traditional Name: 3-(4-nitroimidazol-1-yl)propionic acid methyl ester Formula: C7H9N3O4 MolecularWeight: 199.16406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C=C(N=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCN1C=C(N=C1)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-14-7(11)2-3-9-4-6(8-5-9)10(12)13/h4-5H,2-3H2,1H3