(phenylmethyl) 2-[[2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate

Systemtic Name: (phenylmethyl) 2-[[2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate Openeye Name: benzyl 2-[2-[(5-bromo-2-methoxy-phenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate CAS Name: 2-[[2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate Traditional Name: 2-[2-(5-bromo-2-methoxy-benzylidene)-3-keto-coumaran-6-yl]oxyacetic acid benzyl ester Formula: C25H19BrO6 MolecularWeight: 495.31876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H19BrO6/c1-29-21-10-7-18(26)11-17(21)12-23-25(28)20-9-8-19(13-22(20)32-23)30-15-24(27)31-14-16-5-3-2-4-6-16/h2-13H,14-15H2,1H3