(E)-3-azanyl-2-[2-[3-(trifluoromethyl)phenoxy]ethanoyl]but-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[2-[3-(trifluoromethyl)phenoxy]ethanoyl]but-2-enenitrile Openeye Name: (E)-3-amino-2-[2-[3-(trifluoromethyl)phenoxy]acetyl]but-2-enenitrile CAS Name: (E)-3-amino-2-[1-oxo-2-[3-(trifluoromethyl)phenoxy]ethyl]-2-butenenitrile IUPAC Name: (E)-3-amino-2-[2-[3-(trifluoromethyl)phenoxy]acetyl]but-2-enenitrile Traditional Name: (E)-3-amino-2-[2-[3-(trifluoromethyl)phenoxy]acetyl]but-2-enenitrile Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC1=CC=CC(=C1)C(F)(F)F)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC1=CC=CC(=C1)C(F)(F)F)/N

InChI

InChI=1S/C13H11F3N2O2/c1-8(18)11(6-17)12(19)7-20-10-4-2-3-9(5-10)13(14,15)16/h2-5H,7,18H2,1H3/b11-8+