methyl (1R,4S,6R)-4-chloranyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylate

Systemtic Name: methyl (1R,4S,6R)-4-chloranyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylate Openeye Name: methyl (1R,4S,6R)-4-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylate CAS Name: (1R,4S,6R)-4-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylic acid methyl ester IUPAC Name: methyl (1R,4S,6R)-4-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylate Traditional Name: (1R,4S,6R)-4-chloro-3-keto-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylic acid methyl ester Formula: C9H9ClO4 MolecularWeight: 216.61836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2(C=CC1OC2=O)Cl

Isomeric SMILES

COC(=O)[C@@H]1C[C@@]2(C=C[C@H]1OC2=O)Cl

InChI

InChI=1S/C9H9ClO4/c1-13-7(11)5-4-9(10)3-2-6(5)14-8(9)12/h2-3,5-6H,4H2,1H3/t5-,6-,9-/m1/s1