4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-4-oxo-butanoic acid CAS Name: 4-[2-(2-methyl-5-nitro-1-imidazolyl)ethoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-(2-methyl-5-nitroimidazol-1-yl)ethoxy]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]butyric acid Formula: C10H13N3O6 MolecularWeight: 271.22672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O6/c1-7-11-6-8(13(17)18)12(7)4-5-19-10(16)3-2-9(14)15/h6H,2-5H2,1H3,(H,14,15)