2-(3,5-dimethylpyrazol-1-yl)-1-phenyl-ethanone hydrobromide

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-1-phenyl-ethanone hydrobromide Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-1-phenyl-ethanone hydrobromide CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-1-phenylethanone hydrobromide IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-1-phenylethanone hydrobromide Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-1-phenyl-ethanone hydrobromide Formula: C13H15BrN2O MolecularWeight: 295.175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)C2=CC=CC=C2)C.Br

Isomeric SMILES

CC1=CC(=NN1CC(=O)C2=CC=CC=C2)C.Br

InChI

InChI=1S/C13H14N2O.BrH/c1-10-8-11(2)15(14-10)9-13(16)12-6-4-3-5-7-12;/h3-8H,9H2,1-2H3;1H