3-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]propanenitrile Openeye Name: 3-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]propanenitrile CAS Name: 3-[5-phenyl-3-(trifluoromethyl)-1-pyrazolyl]propanenitrile IUPAC Name: 3-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]propanenitrile Traditional Name: 3-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]propionitrile Formula: C13H10F3N3 MolecularWeight: 265.23381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2CCC#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2CCC#N)C(F)(F)F

InChI

InChI=1S/C13H10F3N3/c14-13(15,16)12-9-11(10-5-2-1-3-6-10)19(18-12)8-4-7-17/h1-3,5-6,9H,4,8H2