5-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione Openeye Name: 2-butyl-5-[(3,5-dibromo-2-hydroxy-phenyl)methylene]-2-methyl-1,3-dioxane-4,6-dione CAS Name: 2-butyl-5-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione IUPAC Name: 2-butyl-5-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione Traditional Name: 2-butyl-5-(3,5-dibromo-2-hydroxy-benzylidene)-2-methyl-1,3-dioxane-4,6-quinone Formula: C16H16Br2O5 MolecularWeight: 448.10324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC(=O)C(=CC2=CC(=CC(=C2O)Br)Br)C(=O)O1)C

Isomeric SMILES

CCCCC1(OC(=O)C(=CC2=CC(=CC(=C2O)Br)Br)C(=O)O1)C

InChI

InChI=1S/C16H16Br2O5/c1-3-4-5-16(2)22-14(20)11(15(21)23-16)7-9-6-10(17)8-12(18)13(9)19/h6-8,19H,3-5H2,1-2H3