N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C14H20N6O3 MolecularWeight: 320.347

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CN(N=C1C)CC)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NCC1=CN(N=C1C)CC)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N6O3/c1-4-13(19-9-12(7-16-19)20(22)23)14(21)15-6-11-8-18(5-2)17-10(11)3/h7-9,13H,4-6H2,1-3H3,(H,15,21)