2-(4-bromanyl-3-chloranyl-phenyl)-4-fluoranyl-4-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 2-(4-bromanyl-3-chloranyl-phenyl)-4-fluoranyl-4-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-allyl-2-(4-bromo-3-chloro-phenyl)-4-fluoro-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-(4-bromo-3-chlorophenyl)-4-fluoro-4-prop-2-enyl-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-(4-bromo-3-chlorophenyl)-4-fluoro-4-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 4-allyl-2-(4-bromo-3-chloro-phenyl)-4-fluoro-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C13H8BrClF4N2O MolecularWeight: 399.566033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(=NN(C1=O)C2=CC(=C(C=C2)Br)Cl)C(F)(F)F)F

Isomeric SMILES

C=CCC1(C(=NN(C1=O)C2=CC(=C(C=C2)Br)Cl)C(F)(F)F)F

InChI

InChI=1S/C13H8BrClF4N2O/c1-2-5-12(16)10(13(17,18)19)20-21(11(12)22)7-3-4-8(14)9(15)6-7/h2-4,6H,1,5H2