2-[1-(3-bromanyl-4-chloranyl-phenyl)ethyl]-5-(trifluoromethyl)-1H-pyrazol-3-one

Systemtic Name: 2-[1-(3-bromanyl-4-chloranyl-phenyl)ethyl]-5-(trifluoromethyl)-1H-pyrazol-3-one Openeye Name: 2-[1-(3-bromo-4-chloro-phenyl)ethyl]-5-(trifluoromethyl)-1H-pyrazol-3-one CAS Name: 2-[1-(3-bromo-4-chlorophenyl)ethyl]-5-(trifluoromethyl)-1H-pyrazol-3-one IUPAC Name: 2-[1-(3-bromo-4-chlorophenyl)ethyl]-5-(trifluoromethyl)-1H-pyrazol-3-one Traditional Name: 2-[1-(3-bromo-4-chloro-phenyl)ethyl]-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C12H9BrClF3N2O MolecularWeight: 369.56487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Br)N2C(=O)C=C(N2)C(F)(F)F

Isomeric SMILES

CC(C1=CC(=C(C=C1)Cl)Br)N2C(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C12H9BrClF3N2O/c1-6(7-2-3-9(14)8(13)4-7)19-11(20)5-10(18-19)12(15,16)17/h2-6,18H,1H3