methyl (2Z)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate

Systemtic Name: methyl (2Z)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-2-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C18H13BrO6 MolecularWeight: 405.19622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)Br)O

InChI

InChI=1S/C18H13BrO6/c1-23-14-6-9(5-12(19)17(14)21)7-15-16(20)11-8-10(18(22)24-2)3-4-13(11)25-15/h3-8,21H,1-2H3/b15-7-