[(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] butanoate

Systemtic Name: [(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] butanoate Openeye Name: [(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] butanoate CAS Name: butanoic acid [(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] ester IUPAC Name: [(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] butanoate Traditional Name: butyric acid [(1S,4S,5S)-5-bicyclo[2.2.2]oct-2-enyl] ester Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1CC2CCC1C=C2

Isomeric SMILES

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

InChI

InChI=1S/C12H18O2/c1-2-3-12(13)14-11-8-9-4-6-10(11)7-5-9/h4,6,9-11H,2-3,5,7-8H2,1H3/t9-,10+,11-/m0/s1