(1S,6S)-6-but-3-ynyl-4,4-dimethyl-bicyclo[4.1.0]heptan-2-one

Systemtic Name: (1S,6S)-6-but-3-ynyl-4,4-dimethyl-bicyclo[4.1.0]heptan-2-one Openeye Name: (1S,6S)-6-but-3-ynyl-4,4-dimethyl-norcaran-2-one CAS Name: (1S,6S)-6-but-3-ynyl-4,4-dimethyl-2-bicyclo[4.1.0]heptanone IUPAC Name: (1S,6S)-6-but-3-ynyl-4,4-dimethylbicyclo[4.1.0]heptan-2-one Traditional Name: (1S,6S)-6-but-3-ynyl-4,4-dimethyl-norcaran-2-one Formula: C13H18O MolecularWeight: 190.28142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2CC2(C1)CCC#C)C

Isomeric SMILES

CC1(CC(=O)[C@H]2C[C@]2(C1)CCC#C)C

InChI

InChI=1S/C13H18O/c1-4-5-6-13-7-10(13)11(14)8-12(2,3)9-13/h1,10H,5-9H2,2-3H3/t10-,13+/m1/s1