(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(4-methyl-3-nitro-phenyl)methanone

Systemtic Name: (4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(4-methyl-3-nitro-phenyl)methanone Openeye Name: (4-bromo-3,5-dimethyl-pyrazol-1-yl)-(4-methyl-3-nitro-phenyl)methanone CAS Name: (4-bromo-3,5-dimethyl-1-pyrazolyl)-(4-methyl-3-nitrophenyl)methanone IUPAC Name: (4-bromo-3,5-dimethylpyrazol-1-yl)-(4-methyl-3-nitrophenyl)methanone Traditional Name: (4-bromo-3,5-dimethyl-pyrazol-1-yl)-(4-methyl-3-nitro-phenyl)methanone Formula: C13H12BrN3O3 MolecularWeight: 338.15668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN3O3/c1-7-4-5-10(6-11(7)17(19)20)13(18)16-9(3)12(14)8(2)15-16/h4-6H,1-3H3