4-ethynyl-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-one

Systemtic Name: 4-ethynyl-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-one Openeye Name: 4-ethynyl-1,7,7-trimethyl-norbornan-2-one CAS Name: 4-ethynyl-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanone IUPAC Name: 4-ethynyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one Traditional Name: 4-ethynyl-1,7,7-trimethyl-norbornan-2-one Formula: C12H16O MolecularWeight: 176.25484

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(CC2=O)C#C)C)C

Isomeric SMILES

CC1(C2(CCC1(CC2=O)C#C)C)C

InChI

InChI=1S/C12H16O/c1-5-12-7-6-11(4,9(13)8-12)10(12,2)3/h1H,6-8H2,2-4H3