4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)pyridin-2-yl]benzamide

Systemtic Name: 4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)pyridin-2-yl]benzamide Openeye Name: 4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)-2-pyridyl]benzamide CAS Name: 4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)-2-pyridinyl]benzamide IUPAC Name: 4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)pyridin-2-yl]benzamide Traditional Name: 4-(3,3-dimethylbut-1-ynyl)-N-[5-(trifluoromethyl)-2-pyridyl]benzamide Formula: C19H17F3N2O MolecularWeight: 346.34629

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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