3-bromanylbicyclo[2.2.2]octa-1,3,5-trien-8-one; cyclohexanone

Systemtic Name: 3-bromanylbicyclo[2.2.2]octa-1,3,5-trien-8-one; cyclohexanone Openeye Name: 3-bromobicyclo[2.2.2]octa-1,3,5-trien-8-one; cyclohexanone CAS Name: 3-bromo-8-bicyclo[2.2.2]octa-1,3,5-trienone; cyclohexanone IUPAC Name: 3-bromobicyclo[2.2.2]octa-1,3,5-trien-8-one; cyclohexanone Traditional Name: 3-bromobicyclo[2.2.2]octa-1,3,5-trien-8-one; cyclohexanone Formula: C14H15BrO2 MolecularWeight: 295.1717

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)CC1.C1C2=CC(=C(C1=O)C=C2)Br

Isomeric SMILES

C1CCC(=O)CC1.C1C2=CC(=C(C1=O)C=C2)Br

InChI

InChI=1S/C8H5BrO.C6H10O/c9-7-3-5-1-2-6(7)8(10)4-5;7-6-4-2-1-3-5-6/h1-3H,4H2;1-5H2