4-fluoranyl-4-prop-2-enyl-3-(trifluoromethyl)-1H-pyrazol-5-one

Systemtic Name: 4-fluoranyl-4-prop-2-enyl-3-(trifluoromethyl)-1H-pyrazol-5-one Openeye Name: 4-allyl-4-fluoro-3-(trifluoromethyl)-1H-pyrazol-5-one CAS Name: 4-fluoro-4-prop-2-enyl-3-(trifluoromethyl)-1H-pyrazol-5-one IUPAC Name: 4-fluoro-4-prop-2-enyl-3-(trifluoromethyl)-1H-pyrazol-5-one Traditional Name: 4-allyl-4-fluoro-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C7H6F4N2O MolecularWeight: 210.128953

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(=NNC1=O)C(F)(F)F)F

Isomeric SMILES

C=CCC1(C(=NNC1=O)C(F)(F)F)F

InChI

InChI=1S/C7H6F4N2O/c1-2-3-6(8)4(7(9,10)11)12-13-5(6)14/h2H,1,3H2,(H,13,14)