4-(2-methyl-4-nitro-imidazol-1-yl)butanoic acid

Systemtic Name: 4-(2-methyl-4-nitro-imidazol-1-yl)butanoic acid Openeye Name: 4-(2-methyl-4-nitro-imidazol-1-yl)butanoic acid CAS Name: 4-(2-methyl-4-nitro-1-imidazolyl)butanoic acid IUPAC Name: 4-(2-methyl-4-nitroimidazol-1-yl)butanoic acid Traditional Name: 4-(2-methyl-4-nitro-imidazol-1-yl)butyric acid Formula: C8H11N3O4 MolecularWeight: 213.19064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H11N3O4/c1-6-9-7(11(14)15)5-10(6)4-2-3-8(12)13/h5H,2-4H2,1H3,(H,12,13)