2,5-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: 2,5-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 2,5-dimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-tert-amylcyclohexyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C17H28N4O3 MolecularWeight: 336.42922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O3/c1-6-17(3,4)12-7-9-13(10-8-12)18-16(22)15-14(21(23)24)11(2)19-20(15)5/h12-13H,6-10H2,1-5H3,(H,18,22)