methyl (1S,4R,8R)-6-chloranyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylate

Systemtic Name: methyl (1S,4R,8R)-6-chloranyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylate Openeye Name: methyl (1S,4R,8R)-6-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylate CAS Name: (1S,4R,8R)-6-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylic acid methyl ester IUPAC Name: methyl (1S,4R,8R)-6-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylate Traditional Name: (1S,4R,8R)-6-chloro-3-keto-2-oxabicyclo[2.2.2]oct-5-ene-8-carboxylic acid methyl ester Formula: C9H9ClO4 MolecularWeight: 216.61836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2C(=CC1C(=O)O2)Cl

Isomeric SMILES

COC(=O)[C@@H]1C[C@H]2C(=C[C@@H]1C(=O)O2)Cl

InChI

InChI=1S/C9H9ClO4/c1-13-8(11)5-3-7-6(10)2-4(5)9(12)14-7/h2,4-5,7H,3H2,1H3/t4-,5+,7-/m0/s1