6-(2-methyl-5-nitro-imidazol-1-yl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(2-methyl-5-nitro-imidazol-1-yl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(2-methyl-5-nitro-imidazol-1-yl)-6-oxo-hexanoic acid CAS Name: 6-(2-methyl-5-nitro-1-imidazolyl)-6-oxohexanoic acid IUPAC Name: 6-(2-methyl-5-nitroimidazol-1-yl)-6-oxohexanoic acid Traditional Name: 6-keto-6-(2-methyl-5-nitro-imidazol-1-yl)hexanoic acid Formula: C10H13N3O5 MolecularWeight: 255.22732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C(=O)CCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1C(=O)CCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O5/c1-7-11-6-8(13(17)18)12(7)9(14)4-2-3-5-10(15)16/h6H,2-5H2,1H3,(H,15,16)