N-[3-(2-pyridin-2-ylethynyl)phenyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-4-(trifluoromethyl)benzamide CAS Name: N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-4-(trifluoromethyl)benzamide Formula: C21H13F3N2O MolecularWeight: 366.33593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H13F3N2O/c22-21(23,24)17-10-8-16(9-11-17)20(27)26-19-6-3-4-15(14-19)7-12-18-5-1-2-13-25-18/h1-6,8-11,13-14H,(H,26,27)