1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]ethanone

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]ethanone Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]ethanone CAS Name: 1-[4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]ethanone IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]ethanone Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]ethanone Formula: C13H13BrN2O MolecularWeight: 293.15912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)C)C)Br

InChI

InChI=1S/C13H13BrN2O/c1-8-13(14)9(2)16(15-8)12-6-4-11(5-7-12)10(3)17/h4-7H,1-3H3