3-tert-butyl-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-tert-butyl-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1,2,4-oxadiazole Formula: C12H17N5O3 MolecularWeight: 279.29508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC(=NO2)C(C)(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NC(=NO2)C(C)(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O3/c1-7-10(17(18)19)8(2)16(14-7)6-9-13-11(15-20-9)12(3,4)5/h6H2,1-5H3