methyl (1R,4R,7S,8S)-7-chloranyl-2,2,6-trimethyl-4-oxidanyl-bicyclo[2.2.2]oct-5-ene-8-carboxylate

Systemtic Name: methyl (1R,4R,7S,8S)-7-chloranyl-2,2,6-trimethyl-4-oxidanyl-bicyclo[2.2.2]oct-5-ene-8-carboxylate Openeye Name: methyl (1R,4R,7S,8S)-7-chloro-4-hydroxy-2,2,6-trimethyl-bicyclo[2.2.2]oct-5-ene-8-carboxylate CAS Name: (1R,4R,7S,8S)-7-chloro-4-hydroxy-2,2,6-trimethyl-8-bicyclo[2.2.2]oct-5-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,4R,7S,8S)-7-chloro-4-hydroxy-2,2,6-trimethylbicyclo[2.2.2]oct-5-ene-8-carboxylate Traditional Name: (1R,4R,7S,8S)-7-chloro-4-hydroxy-2,2,6-trimethyl-bicyclo[2.2.2]oct-5-ene-8-carboxylic acid methyl ester Formula: C13H19ClO3 MolecularWeight: 258.74116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2(CC(C1C(C2C(=O)OC)Cl)(C)C)O

Isomeric SMILES

CC1=C[C@@]2(CC([C@H]1[C@@H]([C@@H]2C(=O)OC)Cl)(C)C)O

InChI

InChI=1S/C13H19ClO3/c1-7-5-13(16)6-12(2,3)8(7)10(14)9(13)11(15)17-4/h5,8-10,16H,6H2,1-4H3/t8-,9-,10+,13+/m1/s1