methyl (1R,4R,8R)-8-butoxy-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylate

Systemtic Name: methyl (1R,4R,8R)-8-butoxy-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylate Openeye Name: methyl (1R,4R,8R)-8-butoxy-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylate CAS Name: (1R,4R,8R)-8-butoxy-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,4R,8R)-8-butoxy-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylate Traditional Name: (1R,4R,8R)-8-butoxy-3-keto-2-oxabicyclo[2.2.2]oct-5-ene-4-carboxylic acid methyl ester Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1CC2C=CC1(C(=O)O2)C(=O)OC

Isomeric SMILES

CCCCO[C@@H]1C[C@@H]2C=C[C@]1(C(=O)O2)C(=O)OC

InChI

InChI=1S/C13H18O5/c1-3-4-7-17-10-8-9-5-6-13(10,11(14)16-2)12(15)18-9/h5-6,9-10H,3-4,7-8H2,1-2H3/t9-,10+,13+/m0/s1