N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C13H15N7O3 MolecularWeight: 317.3033

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N7O3/c1-4-10(19-8(2)5-11(17-19)20(22)23)13(21)16-12-9(6-14)7-15-18(12)3/h5,7,10H,4H2,1-3H3,(H,16,21)