2-methyl-3-oxidanylidene-5-(trifluoromethyl)-1H-pyrazole-4-carbonitrile

Systemtic Name: 2-methyl-3-oxidanylidene-5-(trifluoromethyl)-1H-pyrazole-4-carbonitrile Openeye Name: 2-methyl-3-oxo-5-(trifluoromethyl)-1H-pyrazole-4-carbonitrile CAS Name: 2-methyl-3-oxo-5-(trifluoromethyl)-1H-pyrazole-4-carbonitrile IUPAC Name: 2-methyl-3-oxo-5-(trifluoromethyl)-1H-pyrazole-4-carbonitrile Traditional Name: 5-keto-1-methyl-3-(trifluoromethyl)-3-pyrazoline-4-carbonitrile Formula: C6H4F3N3O MolecularWeight: 191.11067

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1)C(F)(F)F)C#N

Isomeric SMILES

CN1C(=O)C(=C(N1)C(F)(F)F)C#N

InChI

InChI=1S/C6H4F3N3O/c1-12-5(13)3(2-10)4(11-12)6(7,8)9/h11H,1H3