3-oxidanylidenebicyclo[2.2.2]octane-4-carboxylic acid

Systemtic Name: 3-oxidanylidenebicyclo[2.2.2]octane-4-carboxylic acid Openeye Name: 3-oxobicyclo[2.2.2]octane-4-carboxylic acid CAS Name: 3-oxo-4-bicyclo[2.2.2]octanecarboxylic acid IUPAC Name: 3-oxobicyclo[2.2.2]octane-4-carboxylic acid Traditional Name: 3-ketobicyclo[2.2.2]octane-4-carboxylic acid Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1CC2=O)C(=O)O

Isomeric SMILES

C1CC2(CCC1CC2=O)C(=O)O

InChI

InChI=1S/C9H12O3/c10-7-5-6-1-3-9(7,4-2-6)8(11)12/h6H,1-5H2,(H,11,12)