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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2C(=CC(=N2)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2C(=CC(=N2)C)C)[N+](=O)[O-]

InChI

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