ethyl (1S,7R,8S)-8-chloranyl-8-methyl-9-oxidanylidene-bicyclo[5.2.0]nonane-4-carboxylate

Systemtic Name: ethyl (1S,7R,8S)-8-chloranyl-8-methyl-9-oxidanylidene-bicyclo[5.2.0]nonane-4-carboxylate Openeye Name: ethyl (1S,7R,8S)-8-chloro-8-methyl-9-oxo-bicyclo[5.2.0]nonane-4-carboxylate CAS Name: (1S,7R,8S)-8-chloro-8-methyl-9-oxo-4-bicyclo[5.2.0]nonanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,7R,8S)-8-chloro-8-methyl-9-oxobicyclo[5.2.0]nonane-4-carboxylate Traditional Name: (1S,7R,8S)-8-chloro-9-keto-8-methyl-bicyclo[5.2.0]nonane-4-carboxylic acid ethyl ester Formula: C13H19ClO3 MolecularWeight: 258.74116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC2C(CC1)C(C2=O)(C)Cl

Isomeric SMILES

CCOC(=O)C1CC[C@H]2[C@@H](CC1)[C@](C2=O)(C)Cl

InChI

InChI=1S/C13H19ClO3/c1-3-17-12(16)8-4-6-9-10(7-5-8)13(2,14)11(9)15/h8-10H,3-7H2,1-2H3/t8?,9-,10+,13-/m0/s1