1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-propan-2-yl-pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-isopropyl-pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-propan-2-ylpyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-isopropyl-pyrazole-3-carboxamide Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H18N6O3/c1-8(2)14-13(20)11-5-6-17(16-11)7-18-10(4)12(19(21)22)9(3)15-18/h5-6,8H,7H2,1-4H3,(H,14,20)