(2E)-3-oxidanylidene-2-[oxidanyl-(trifluoromethylamino)methylidene]-4-phenyl-butanenitrile

Systemtic Name: (2E)-3-oxidanylidene-2-[oxidanyl-(trifluoromethylamino)methylidene]-4-phenyl-butanenitrile Openeye Name: (2E)-2-[hydroxy-(trifluoromethylamino)methylene]-3-oxo-4-phenyl-butanenitrile CAS Name: (2E)-2-[hydroxy-(trifluoromethylamino)methylidene]-3-oxo-4-phenylbutanenitrile IUPAC Name: (2E)-2-[hydroxy-(trifluoromethylamino)methylidene]-3-oxo-4-phenylbutanenitrile Traditional Name: (E)-3-hydroxy-2-(2-phenylacetyl)-3-(trifluoromethylamino)acrylonitrile Formula: C12H9F3N2O2 MolecularWeight: 270.20727

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9F3N2O2/c13-12(14,15)17-11(19)9(7-16)10(18)6-8-4-2-1-3-5-8/h1-5,17,19H,6H2/b11-9+