2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

Systemtic Name: 2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Openeye Name: 2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-one CAS Name: 2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-one IUPAC Name: 2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Traditional Name: 2-(3,4-dimethylphenyl)-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C12H11F3N2O MolecularWeight: 256.22375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C=C(N2)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C=C(N2)C(F)(F)F)C

InChI

InChI=1S/C12H11F3N2O/c1-7-3-4-9(5-8(7)2)17-11(18)6-10(16-17)12(13,14)15/h3-6,16H,1-2H3