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

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(2,4-dimethylphenyl)ethanone Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(2,4-dimethylphenyl)ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(2,4-dimethylphenyl)ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-(2,4-dimethylphenyl)ethanone Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(2,4-dimethylphenyl)ethanone Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C15H17N3O3/c1-9-5-6-13(10(2)7-9)14(19)8-17-12(4)15(18(20)21)11(3)16-17/h5-7H,8H2,1-4H3