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

Systemtic Name: 4,5-dimethyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Openeye Name: 4,5-dimethyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one CAS Name: 4,5-dimethyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one IUPAC Name: 4,5-dimethyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Traditional Name: 4,5-dimethyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-3-pyrazolin-3-one Formula: C14H15F3N2O MolecularWeight: 284.27691

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)C(C)C2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC1=C(NN(C1=O)C(C)C2=CC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C14H15F3N2O/c1-8-9(2)18-19(13(8)20)10(3)11-4-6-12(7-5-11)14(15,16)17/h4-7,10,18H,1-3H3