N-(1-ethyl-5-methyl-pyrazol-4-yl)-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(1-ethyl-5-methyl-pyrazol-4-yl)-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(1-ethyl-5-methyl-pyrazol-4-yl)-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(1-ethyl-5-methyl-4-pyrazolyl)-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(1-ethyl-5-methylpyrazol-4-yl)-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(1-ethyl-5-methyl-pyrazol-4-yl)-2-(4-nitropyrazol-1-yl)butyramide Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(N(N=C1)CC)C)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=C(N(N=C1)CC)C)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N6O3/c1-4-12(18-8-10(6-14-18)19(21)22)13(20)16-11-7-15-17(5-2)9(11)3/h6-8,12H,4-5H2,1-3H3,(H,16,20)