1-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one Openeye Name: 1-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one CAS Name: 1-(4-bromo-3,5-dimethyl-1-pyrazolyl)-3-phenyl-2-propyn-1-one IUPAC Name: 1-(4-bromo-3,5-dimethylpyrazol-1-yl)-3-phenylprop-2-yn-1-one Traditional Name: 1-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-phenyl-prop-2-yn-1-one Formula: C14H11BrN2O MolecularWeight: 303.15394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C#CC2=CC=CC=C2)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)C#CC2=CC=CC=C2)C)Br

InChI

InChI=1S/C14H11BrN2O/c1-10-14(15)11(2)17(16-10)13(18)9-8-12-6-4-3-5-7-12/h3-7H,1-2H3