2,3-dideuterio-3-[4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]phenyl]propanenitrile

Systemtic Name: 2,3-dideuterio-3-[4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]phenyl]propanenitrile Openeye Name: 2,3-dideuterio-3-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]propanenitrile CAS Name: 2,3-dideuterio-3-[4-[3-(trifluoromethyl)-3-diazirinyl]phenyl]propanenitrile IUPAC Name: 2,3-dideuterio-3-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]propanenitrile Traditional Name: 2,3-dideuterio-3-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]propionitrile Formula: C11H8F3N3 MolecularWeight: 241.208853

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC#N)C2(N=N2)C(F)(F)F

Isomeric SMILES

[2H]C(C#N)C([2H])C1=CC=C(C=C1)C2(N=N2)C(F)(F)F

InChI

InChI=1S/C11H8F3N3/c12-11(13,14)10(16-17-10)9-5-3-8(4-6-9)2-1-7-15/h3-6H,1-2H2/i1D,2D