N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=C1)CNC(=O)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NNC(=C1)CNC(=O)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N6O3/c1-13(2,3)11-4-9(16-17-11)5-14-12(20)8-18-7-10(6-15-18)19(21)22/h4,6-7H,5,8H2,1-3H3,(H,14,20)(H,16,17)