N-[4-cyano-2-methyl-5-(1-methyl-5-nitro-imidazol-2-yl)pyrazol-3-yl]-2-oxidanylidene-propanamide

Systemtic Name: N-[4-cyano-2-methyl-5-(1-methyl-5-nitro-imidazol-2-yl)pyrazol-3-yl]-2-oxidanylidene-propanamide Openeye Name: N-[4-cyano-2-methyl-5-(1-methyl-5-nitro-imidazol-2-yl)pyrazol-3-yl]-2-oxo-propanamide CAS Name: N-[4-cyano-2-methyl-5-(1-methyl-5-nitro-2-imidazolyl)-3-pyrazolyl]-2-oxopropanamide IUPAC Name: N-[4-cyano-2-methyl-5-(1-methyl-5-nitroimidazol-2-yl)pyrazol-3-yl]-2-oxopropanamide Traditional Name: N-[4-cyano-2-methyl-5-(1-methyl-5-nitro-imidazol-2-yl)pyrazol-3-yl]-2-keto-propionamide Formula: C12H11N7O4 MolecularWeight: 317.26024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)NC1=C(C(=NN1C)C2=NC=C(N2C)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)C(=O)NC1=C(C(=NN1C)C2=NC=C(N2C)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H11N7O4/c1-6(20)12(21)15-10-7(4-13)9(16-18(10)3)11-14-5-8(17(11)2)19(22)23/h5H,1-3H3,(H,15,21)