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

Systemtic Name: 7-[2,4-bis(oxidanylidene)pentan-3-yl]-6-bromanyl-3-(phenylcarbonyl)-1-benzofuran-4,5-dione Openeye Name: 7-(1-acetyl-2-oxo-propyl)-3-benzoyl-6-bromo-benzofuran-4,5-dione CAS Name: 3-benzoyl-6-bromo-7-(2,4-dioxopentan-3-yl)benzofuran-4,5-dione IUPAC Name: 3-benzoyl-6-bromo-7-(2,4-dioxopentan-3-yl)-1-benzofuran-4,5-dione Traditional Name: 7-(1-acetyl-2-keto-propyl)-3-benzoyl-6-bromo-benzofuran-4,5-quinone Formula: C20H13BrO6 MolecularWeight: 429.21762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=C(C(=O)C(=O)C2=C1OC=C2C(=O)C3=CC=CC=C3)Br)C(=O)C

Isomeric SMILES

CC(=O)C(C1=C(C(=O)C(=O)C2=C1OC=C2C(=O)C3=CC=CC=C3)Br)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/h3-8,13H,1-2H3