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

Systemtic Name: 1,2-dimethyl-4-[3-(trifluoromethyl)phenyl]pyrazol-3-one Openeye Name: 1,2-dimethyl-4-[3-(trifluoromethyl)phenyl]pyrazol-3-one CAS Name: 1,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-3-pyrazolone IUPAC Name: 1,2-dimethyl-4-[3-(trifluoromethyl)phenyl]pyrazol-3-one Traditional Name: 1,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-3-pyrazolin-3-one Formula: C12H11F3N2O MolecularWeight: 256.22375

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N1C)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CN1C=C(C(=O)N1C)C2=CC(=CC=C2)C(F)(F)F

InChI

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