2-ethyl-2-[4-(trifluoromethyl)phenyl]but-3-enenitrile

Systemtic Name: 2-ethyl-2-[4-(trifluoromethyl)phenyl]but-3-enenitrile Openeye Name: 2-ethyl-2-[4-(trifluoromethyl)phenyl]but-3-enenitrile CAS Name: 2-ethyl-2-[4-(trifluoromethyl)phenyl]-3-butenenitrile IUPAC Name: 2-ethyl-2-[4-(trifluoromethyl)phenyl]but-3-enenitrile Traditional Name: 2-ethyl-2-[4-(trifluoromethyl)phenyl]but-3-enenitrile Formula: C13H12F3N MolecularWeight: 239.23629

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C)(C#N)C1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCC(C=C)(C#N)C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C13H12F3N/c1-3-12(4-2,9-17)10-5-7-11(8-6-10)13(14,15)16/h3,5-8H,1,4H2,2H3