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

Systemtic Name: 3-[4-bromanyl-5-(trifluoromethyl)pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-bromo-5-(trifluoromethyl)pyrazol-1-yl]propanenitrile CAS Name: 3-[4-bromo-5-(trifluoromethyl)-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-bromo-5-(trifluoromethyl)pyrazol-1-yl]propanenitrile Traditional Name: 3-[4-bromo-5-(trifluoromethyl)pyrazol-1-yl]propionitrile Formula: C7H5BrF3N3 MolecularWeight: 268.03391

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C(=C1Br)C(F)(F)F)CCC#N

Isomeric SMILES

C1=NN(C(=C1Br)C(F)(F)F)CCC#N

InChI

InChI=1S/C7H5BrF3N3/c8-5-4-13-14(3-1-2-12)6(5)7(9,10)11/h4H,1,3H2