4-[(1R,5S,6S)-4-methylidene-5-bicyclo[4.1.0]heptanyl]butan-2-one

Systemtic Name: 4-[(1R,5S,6S)-4-methylidene-5-bicyclo[4.1.0]heptanyl]butan-2-one Openeye Name: 4-[(1S,2S,6R)-3-methylenenorcaran-2-yl]butan-2-one CAS Name: 4-[(1R,5S,6S)-4-methylene-5-bicyclo[4.1.0]heptanyl]-2-butanone IUPAC Name: 4-[(1R,5S,6S)-4-methylidene-5-bicyclo[4.1.0]heptanyl]butan-2-one Traditional Name: 4-[(1S,2S,6R)-3-methylenenorcaran-2-yl]butan-2-one Formula: C12H18O MolecularWeight: 178.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C2CC2CCC1=C

Isomeric SMILES

CC(=O)CC[C@H]1[C@H]2C[C@H]2CCC1=C

InChI

InChI=1S/C12H18O/c1-8-3-5-10-7-12(10)11(8)6-4-9(2)13/h10-12H,1,3-7H2,2H3/t10-,11-,12+/m1/s1