[(2Z)-2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-bromanylbenzoate

Systemtic Name: [(2Z)-2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-bromanylbenzoate Openeye Name: [(2Z)-2-[(3-methoxyphenyl)methylene]-3-oxo-benzofuran-6-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(2Z)-2-[(3-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(3-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(2Z)-3-keto-2-m-anisylidene-coumaran-6-yl] ester Formula: C23H15BrO5 MolecularWeight: 451.2662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=CC(=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H15BrO5/c1-27-17-4-2-3-14(11-17)12-21-22(25)19-10-9-18(13-20(19)29-21)28-23(26)15-5-7-16(24)8-6-15/h2-13H,1H3/b21-12-