6-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: 6-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Openeye Name: 6-[(2-chloro-6-fluoro-phenyl)methoxy]-2-(4-pyridylmethylene)benzofuran-3-one CAS Name: 6-[(2-chloro-6-fluorophenyl)methoxy]-2-(pyridin-4-ylmethylidene)-3-benzofuranone IUPAC Name: 6-[(2-chloro-6-fluorophenyl)methoxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Traditional Name: 6-(2-chloro-6-fluoro-benzyl)oxy-2-(4-pyridylmethylene)coumaran-3-one Formula: C21H13ClFNO3 MolecularWeight: 381.784223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=NC=C4)O3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=NC=C4)O3)F

InChI

InChI=1S/C21H13ClFNO3/c22-17-2-1-3-18(23)16(17)12-26-14-4-5-15-19(11-14)27-20(21(15)25)10-13-6-8-24-9-7-13/h1-11H,12H2