6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 6-(3,3-dimethylbut-1-ynyl)-N-[4-(trifluoromethyl)phenyl]nicotinamide Formula: C19H17F3N2O MolecularWeight: 346.34629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C#CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O/c1-18(2,3)11-10-15-7-4-13(12-23-15)17(25)24-16-8-5-14(6-9-16)19(20,21)22/h4-9,12H,1-3H3,(H,24,25)