tert-butyl 2-[[2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate

Systemtic Name: tert-butyl 2-[[2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate Openeye Name: tert-butyl 2-[2-[(2-chloro-6-fluoro-phenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate CAS Name: 2-[[2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate Traditional Name: 2-[2-(2-chloro-6-fluoro-benzylidene)-3-keto-coumaran-6-yl]oxyacetic acid tert-butyl ester Formula: C21H18ClFO5 MolecularWeight: 404.816023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC=C3Cl)F)O2

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC=C3Cl)F)O2

InChI

InChI=1S/C21H18ClFO5/c1-21(2,3)28-19(24)11-26-12-7-8-13-17(9-12)27-18(20(13)25)10-14-15(22)5-4-6-16(14)23/h4-10H,11H2,1-3H3