3-(3-methylbutanoylamino)-N-[4-(trifluoromethyloxy)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(3-methylbutanoylamino)-N-[4-(trifluoromethyloxy)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(3-methylbutanoylamino)-N-[4-(trifluoromethoxy)phenyl]benzofuran-2-carboxamide CAS Name: 3-[(3-methyl-1-oxobutyl)amino]-N-[4-(trifluoromethoxy)phenyl]-2-benzofurancarboxamide IUPAC Name: 3-(3-methylbutanoylamino)-N-[4-(trifluoromethoxy)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-(isovalerylamino)-N-[4-(trifluoromethoxy)phenyl]coumarilamide Formula: C21H19F3N2O4 MolecularWeight: 420.38177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(C)CC(=O)NC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H19F3N2O4/c1-12(2)11-17(27)26-18-15-5-3-4-6-16(15)29-19(18)20(28)25-13-7-9-14(10-8-13)30-21(22,23)24/h3-10,12H,11H2,1-2H3,(H,25,28)(H,26,27)