6-(2,3-dihydro-1-benzofuran-5-yl)-2-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(2,3-dihydro-1-benzofuran-5-yl)-2-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 1-benzyl-6-(2,3-dihydrobenzofuran-5-yl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(2,3-dihydrobenzofuran-5-yl)-2-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 1-benzyl-6-(2,3-dihydro-1-benzofuran-5-yl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 1-benzyl-6-coumaran-5-yl-2-keto-4-(trifluoromethyl)nicotinonitrile Formula: C22H15F3N2O2 MolecularWeight: 396.36191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=CC(=C(C(=O)N3CC4=CC=CC=C4)C#N)C(F)(F)F

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=CC(=C(C(=O)N3CC4=CC=CC=C4)C#N)C(F)(F)F

InChI

InChI=1S/C22H15F3N2O2/c23-22(24,25)18-11-19(15-6-7-20-16(10-15)8-9-29-20)27(21(28)17(18)12-26)13-14-4-2-1-3-5-14/h1-7,10-11H,8-9,13H2