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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C=C(N=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCN1C=C(N=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H11N3O4/c1-15-8(12)3-2-4-10-5-7(9-6-10)11(13)14/h5-6H,2-4H2,1H3