4,7,7-trimethyl-2-propanoyl-bicyclo[2.2.1]heptan-3-one

Systemtic Name: 4,7,7-trimethyl-2-propanoyl-bicyclo[2.2.1]heptan-3-one Openeye Name: 1,7,7-trimethyl-3-propanoyl-norbornan-2-one CAS Name: 4,7,7-trimethyl-2-(1-oxopropyl)-3-bicyclo[2.2.1]heptanone IUPAC Name: 4,7,7-trimethyl-2-propanoylbicyclo[2.2.1]heptan-3-one Traditional Name: 1,7,7-trimethyl-3-propionyl-norbornan-2-one Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C2CCC(C1=O)(C2(C)C)C

Isomeric SMILES

CCC(=O)C1C2CCC(C1=O)(C2(C)C)C

InChI

InChI=1S/C13H20O2/c1-5-9(14)10-8-6-7-13(4,11(10)15)12(8,2)3/h8,10H,5-7H2,1-4H3