(1S,4R,5R)-4-butylbicyclo[3.2.1]oct-2-en-8-one

Systemtic Name: (1S,4R,5R)-4-butylbicyclo[3.2.1]oct-2-en-8-one Openeye Name: (1S,4R,5R)-4-butylbicyclo[3.2.1]oct-2-en-8-one CAS Name: (1S,4R,5R)-4-butyl-8-bicyclo[3.2.1]oct-2-enone IUPAC Name: (1S,4R,5R)-4-butylbicyclo[3.2.1]oct-2-en-8-one Traditional Name: (1S,4R,5R)-4-butylbicyclo[3.2.1]oct-2-en-8-one Formula: C12H18O MolecularWeight: 178.27072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CC2CCC1C2=O

Isomeric SMILES

CCCC[C@@H]1C=C[C@@H]2CC[C@H]1C2=O

InChI

InChI=1S/C12H18O/c1-2-3-4-9-5-6-10-7-8-11(9)12(10)13/h5-6,9-11H,2-4,7-8H2,1H3/t9-,10-,11-/m1/s1