3-[5-oxidanylidene-3-(trifluoromethyl)-4H-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[5-oxidanylidene-3-(trifluoromethyl)-4H-pyrazol-1-yl]propanenitrile Openeye Name: 3-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]propanenitrile CAS Name: 3-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]propanenitrile IUPAC Name: 3-[5-oxo-3-(trifluoromethyl)-4H-pyrazol-1-yl]propanenitrile Traditional Name: 3-[5-keto-3-(trifluoromethyl)-2-pyrazolin-1-yl]propionitrile Formula: C7H6F3N3O MolecularWeight: 205.13725

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)CCC#N)C(F)(F)F

Isomeric SMILES

C1C(=NN(C1=O)CCC#N)C(F)(F)F

InChI

InChI=1S/C7H6F3N3O/c8-7(9,10)5-4-6(14)13(12-5)3-1-2-11/h1,3-4H2