4-bromanyl-7-oxidanylidene-6-oxabicyclo[3.2.1]octane-2-carboxylic acid

Systemtic Name: 4-bromanyl-7-oxidanylidene-6-oxabicyclo[3.2.1]octane-2-carboxylic acid Openeye Name: 4-bromo-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylic acid CAS Name: 4-bromo-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylic acid IUPAC Name: 4-bromo-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylic acid Traditional Name: 4-bromo-7-keto-6-oxabicyclo[3.2.1]octane-2-carboxylic acid Formula: C8H9BrO4 MolecularWeight: 249.05866

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(CC(C1OC2=O)Br)C(=O)O

Isomeric SMILES

C1C2C(CC(C1OC2=O)Br)C(=O)O

InChI

InChI=1S/C8H9BrO4/c9-5-1-3(7(10)11)4-2-6(5)13-8(4)12/h3-6H,1-2H2,(H,10,11)