methyl 4-[[2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[2-[(5-bromo-2-methoxy-phenyl)methylene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate CAS Name: 4-[[2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate Traditional Name: 4-[[2-(5-bromo-2-methoxy-benzylidene)-3-keto-coumaran-6-yl]oxymethyl]benzoic acid methyl 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)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H19BrO6/c1-29-21-10-7-18(26)11-17(21)12-23-24(27)20-9-8-19(13-22(20)32-23)31-14-15-3-5-16(6-4-15)25(28)30-2/h3-13H,14H2,1-2H3