(3,5-dimethylpyrazol-1-yl)-(2-methyl-4-nitro-phenyl)methanone

Systemtic Name: (3,5-dimethylpyrazol-1-yl)-(2-methyl-4-nitro-phenyl)methanone Openeye Name: (3,5-dimethylpyrazol-1-yl)-(2-methyl-4-nitro-phenyl)methanone CAS Name: (3,5-dimethyl-1-pyrazolyl)-(2-methyl-4-nitrophenyl)methanone IUPAC Name: (3,5-dimethylpyrazol-1-yl)-(2-methyl-4-nitrophenyl)methanone Traditional Name: (3,5-dimethylpyrazol-1-yl)-(2-methyl-4-nitro-phenyl)methanone Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C13H13N3O3/c1-8-6-11(16(18)19)4-5-12(8)13(17)15-10(3)7-9(2)14-15/h4-7H,1-3H3