(E)-3-cyano-4-oxidanyl-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide

Systemtic Name: (E)-3-cyano-4-oxidanyl-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide Openeye Name: (E)-3-cyano-4-hydroxy-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide CAS Name: (E)-3-cyano-4-hydroxy-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide IUPAC Name: (E)-3-cyano-4-hydroxy-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide Traditional Name: (E)-3-cyano-4-hydroxy-N-[2-(trifluoromethyl)phenyl]oct-3-en-7-ynamide Formula: C16H13F3N2O2 MolecularWeight: 322.28183

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC(=C(CC(=O)NC1=CC=CC=C1C(F)(F)F)C#N)O

Isomeric SMILES

C#CCC/C(=C(/CC(=O)NC1=CC=CC=C1C(F)(F)F)\C#N)/O

InChI

InChI=1S/C16H13F3N2O2/c1-2-3-8-14(22)11(10-20)9-15(23)21-13-7-5-4-6-12(13)16(17,18)19/h1,4-7,22H,3,8-9H2,(H,21,23)/b14-11+