ethyl 3-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]benzofuran-2-carboxylate CAS Name: 3-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[2-keto-5-(trifluoromethyl)-1-pyridyl]methyl]coumarilic acid ethyl ester Formula: C18H14F3NO4 MolecularWeight: 365.30327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=C(C=CC3=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=C(C=CC3=O)C(F)(F)F

InChI

InChI=1S/C18H14F3NO4/c1-2-25-17(24)16-13(12-5-3-4-6-14(12)26-16)10-22-9-11(18(19,20)21)7-8-15(22)23/h3-9H,2,10H2,1H3