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

Systemtic Name: methyl 3-(4-nitroimidazol-1-yl)butanoate Openeye Name: methyl 3-(4-nitroimidazol-1-yl)butanoate CAS Name: 3-(4-nitro-1-imidazolyl)butanoic acid methyl ester IUPAC Name: methyl 3-(4-nitroimidazol-1-yl)butanoate Traditional Name: 3-(4-nitroimidazol-1-yl)butyric acid methyl ester Formula: C8H11N3O4 MolecularWeight: 213.19064

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)N1C=C(N=C1)[N+](=O)[O-]

Isomeric SMILES

CC(CC(=O)OC)N1C=C(N=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H11N3O4/c1-6(3-8(12)15-2)10-4-7(9-5-10)11(13)14/h4-6H,3H2,1-2H3