2-cyano-3-oxidanyl-N-[4-(trifluoromethyl)phenyl]hept-6-ynamide

Systemtic Name: 2-cyano-3-oxidanyl-N-[4-(trifluoromethyl)phenyl]hept-6-ynamide Openeye Name: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-6-ynamide CAS Name: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]-6-heptynamide IUPAC Name: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-6-ynamide Traditional Name: 2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-6-ynamide Formula: C15H13F3N2O2 MolecularWeight: 310.27113

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC(C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)O

Isomeric SMILES

C#CCCC(C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)O

InChI

InChI=1S/C15H13F3N2O2/c1-2-3-4-13(21)12(9-19)14(22)20-11-7-5-10(6-8-11)15(16,17)18/h1,5-8,12-13,21H,3-4H2,(H,20,22)