1-(4-bromanylpyrazol-1-yl)-2-(3,5-dimethylphenoxy)ethanone

Systemtic Name: 1-(4-bromanylpyrazol-1-yl)-2-(3,5-dimethylphenoxy)ethanone Openeye Name: 1-(4-bromopyrazol-1-yl)-2-(3,5-dimethylphenoxy)ethanone CAS Name: 1-(4-bromo-1-pyrazolyl)-2-(3,5-dimethylphenoxy)ethanone IUPAC Name: 1-(4-bromopyrazol-1-yl)-2-(3,5-dimethylphenoxy)ethanone Traditional Name: 1-(4-bromopyrazol-1-yl)-2-(3,5-dimethylphenoxy)ethanone Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2C=C(C=N2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2C=C(C=N2)Br)C

InChI

InChI=1S/C13H13BrN2O2/c1-9-3-10(2)5-12(4-9)18-8-13(17)16-7-11(14)6-15-16/h3-7H,8H2,1-2H3