N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-nitropyrazol-1-yl)butyramide Formula: C12H13N7O3 MolecularWeight: 303.27672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C)C#N)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C)C#N)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N7O3/c1-3-10(18-7-9(6-15-18)19(21)22)12(20)16-11-8(4-13)5-14-17(11)2/h5-7,10H,3H2,1-2H3,(H,16,20)