7-[2,4-bis(oxidanylidene)pentan-3-ylidene]-6-bromanyl-4-oxidanylidene-3-(phenylcarbonyl)-1-benzofuran-5-olate

Systemtic Name: 7-[2,4-bis(oxidanylidene)pentan-3-ylidene]-6-bromanyl-4-oxidanylidene-3-(phenylcarbonyl)-1-benzofuran-5-olate Openeye Name: 7-(1-acetyl-2-oxo-propylidene)-3-benzoyl-6-bromo-4-oxo-benzofuran-5-olate CAS Name: 3-benzoyl-6-bromo-7-(2,4-dioxopentan-3-ylidene)-4-oxo-5-benzofuranolate IUPAC Name: 3-benzoyl-6-bromo-7-(2,4-dioxopentan-3-ylidene)-4-oxo-1-benzofuran-5-olate Traditional Name: 7-(1-acetyl-2-keto-propylidene)-3-benzoyl-6-bromo-4-keto-benzofuran-5-olate Formula: C20H12BrO6- MolecularWeight: 428.20968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1C2=C(C(=CO2)C(=O)C3=CC=CC=C3)C(=O)C(=C1Br)[O-])C(=O)C

Isomeric SMILES

CC(=O)C(=C1C2=C(C(=CO2)C(=O)C3=CC=CC=C3)C(=O)C(=C1Br)[O-])C(=O)C

InChI

InChI=1S/C20H13BrO6/c1-9(22)13(10(2)23)15-16(21)19(26)18(25)14-12(8-27-20(14)15)17(24)11-6-4-3-5-7-11/h3-8,26H,1-2H3/p-1