5,5-bis(trifluoromethyl)pyrazole-3-carbonitrile

Systemtic Name: 5,5-bis(trifluoromethyl)pyrazole-3-carbonitrile Openeye Name: 5,5-bis(trifluoromethyl)pyrazole-3-carbonitrile CAS Name: 5,5-bis(trifluoromethyl)-3-pyrazolecarbonitrile IUPAC Name: 5,5-bis(trifluoromethyl)pyrazole-3-carbonitrile Traditional Name: 5,5-bis(trifluoromethyl)pyrazole-3-carbonitrile Formula: C6HF6N3 MolecularWeight: 229.082659

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=NC1(C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

C1=C(N=NC1(C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C6HF6N3/c7-5(8,9)4(6(10,11)12)1-3(2-13)14-15-4/h1H