2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 5-[[azanyl-(oxidanylamino)methylidene]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 5-[[azanyl-(oxidanylamino)methylidene]amino]-5-oxidanylidene-pentanoate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 5-[[amino-(hydroxyamino)methylene]amino]-5-oxo-pentanoate CAS Name: 5-[[amino-(hydroxyamino)methylidene]amino]-5-oxopentanoic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 5-[[amino-(hydroxyamino)methylidene]amino]-5-oxopentanoate Traditional Name: 5-[[amino-(hydroxyamino)methylene]amino]-5-keto-valeric acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C12H18N6O6 MolecularWeight: 342.30792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)CCCC(=O)N=C(N)NO)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)CCCC(=O)N=C(N)NO)[N+](=O)[O-]

InChI

InChI=1S/C12H18N6O6/c1-8-14-7-10(18(22)23)17(8)5-6-24-11(20)4-2-3-9(19)15-12(13)16-21/h7,21H,2-6H2,1H3,(H3,13,15,16,19)