[2-[(5-methylfuran-2-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 2-bromanylbenzoate

Systemtic Name: [2-[(5-methylfuran-2-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 2-bromanylbenzoate Openeye Name: [2-[(5-methyl-2-furyl)methylene]-3-oxo-benzofuran-6-yl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-[(5-methyl-2-furanyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [3-keto-2-[(5-methyl-2-furyl)methylene]coumaran-6-yl] ester Formula: C21H13BrO5 MolecularWeight: 425.22892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CC1=CC=C(O1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C21H13BrO5/c1-12-6-7-13(25-12)11-19-20(23)16-9-8-14(10-18(16)27-19)26-21(24)15-4-2-3-5-17(15)22/h2-11H,1H3