3-[3-(bromomethyl)-1-ethanoyl-5-methyl-pyrazol-4-yl]oxy-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[3-(bromomethyl)-1-ethanoyl-5-methyl-pyrazol-4-yl]oxy-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[1-acetyl-3-(bromomethyl)-5-methyl-pyrazol-4-yl]oxy-5-fluoro-benzonitrile CAS Name: 3-[[1-acetyl-3-(bromomethyl)-5-methyl-4-pyrazolyl]oxy]-5-fluorobenzonitrile IUPAC Name: 3-[1-acetyl-3-(bromomethyl)-5-methylpyrazol-4-yl]oxy-5-fluorobenzonitrile Traditional Name: 3-[1-acetyl-3-(bromomethyl)-5-methyl-pyrazol-4-yl]oxy-5-fluoro-benzonitrile Formula: C14H11BrFN3O2 MolecularWeight: 352.158443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C)CBr)OC2=CC(=CC(=C2)C#N)F

Isomeric SMILES

CC1=C(C(=NN1C(=O)C)CBr)OC2=CC(=CC(=C2)C#N)F

InChI

InChI=1S/C14H11BrFN3O2/c1-8-14(13(6-15)18-19(8)9(2)20)21-12-4-10(7-17)3-11(16)5-12/h3-5H,6H2,1-2H3