2-(4-bromanyl-3-methyl-phenoxy)-1-(3-methylpyrazol-1-yl)ethanone

Systemtic Name: 2-(4-bromanyl-3-methyl-phenoxy)-1-(3-methylpyrazol-1-yl)ethanone Openeye Name: 2-(4-bromo-3-methyl-phenoxy)-1-(3-methylpyrazol-1-yl)ethanone CAS Name: 2-(4-bromo-3-methylphenoxy)-1-(3-methyl-1-pyrazolyl)ethanone IUPAC Name: 2-(4-bromo-3-methylphenoxy)-1-(3-methylpyrazol-1-yl)ethanone Traditional Name: 2-(4-bromo-3-methyl-phenoxy)-1-(3-methylpyrazol-1-yl)ethanone Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)C(=O)COC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CC1=NN(C=C1)C(=O)COC2=CC(=C(C=C2)Br)C

InChI

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