[3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-bromanylbenzoate

Systemtic Name: [3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-bromanylbenzoate Openeye Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [3-keto-2-(3,4,5-trimethoxybenzylidene)coumaran-6-yl] ester Formula: C25H19BrO7 MolecularWeight: 511.31816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H19BrO7/c1-29-21-11-14(12-22(30-2)24(21)31-3)10-20-23(27)18-9-8-17(13-19(18)33-20)32-25(28)15-4-6-16(26)7-5-15/h4-13H,1-3H3