1-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanone

Systemtic Name: 1-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanone Openeye Name: 1-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)ethanone CAS Name: 1-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-(4-iodo-3,5-dimethyl-1-pyrazolyl)ethanone IUPAC Name: 1-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-(4-iodo-3,5-dimethylpyrazol-1-yl)ethanone Traditional Name: 1-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)ethanone Formula: C12H14IN5O3 MolecularWeight: 403.17573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)CN2C(=C(C(=N2)C)I)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(=O)CN2C(=C(C(=N2)C)I)C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H14IN5O3/c1-6-11(13)8(3)16(14-6)5-10(19)17-9(4)12(18(20)21)7(2)15-17/h5H2,1-4H3