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

Systemtic Name: 2-[1-[4-chloranyl-3-(trifluoromethyl)phenyl]ethyl]-5-methyl-1H-pyrazol-3-one Openeye Name: 2-[1-[4-chloro-3-(trifluoromethyl)phenyl]ethyl]-5-methyl-1H-pyrazol-3-one CAS Name: 2-[1-[4-chloro-3-(trifluoromethyl)phenyl]ethyl]-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-[1-[4-chloro-3-(trifluoromethyl)phenyl]ethyl]-5-methyl-1H-pyrazol-3-one Traditional Name: 2-[1-[4-chloro-3-(trifluoromethyl)phenyl]ethyl]-5-methyl-3-pyrazolin-3-one Formula: C13H12ClF3N2O MolecularWeight: 304.69539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C13H12ClF3N2O/c1-7-5-12(20)19(18-7)8(2)9-3-4-11(14)10(6-9)13(15,16)17/h3-6,8,18H,1-2H3