cyclooctyl (1S,6R,7R)-7-cyano-5-oxidanylidene-bicyclo[4.1.0]heptane-7-carboxylate

Systemtic Name: cyclooctyl (1S,6R,7R)-7-cyano-5-oxidanylidene-bicyclo[4.1.0]heptane-7-carboxylate Openeye Name: cyclooctyl (1R,6S,7R)-7-cyano-2-oxo-norcarane-7-carboxylate CAS Name: (1S,6R,7R)-7-cyano-5-oxo-7-bicyclo[4.1.0]heptanecarboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl (1S,6R,7R)-7-cyano-5-oxobicyclo[4.1.0]heptane-7-carboxylate Traditional Name: (1R,6S,7R)-7-cyano-2-keto-norcarane-7-carboxylic acid cyclooctyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)OC(=O)C2(C3C2C(=O)CCC3)C#N

Isomeric SMILES

C1CCCC(CCC1)OC(=O)[C@@]2([C@@H]3[C@H]2C(=O)CCC3)C#N

InChI

InChI=1S/C17H23NO3/c18-11-17(13-9-6-10-14(19)15(13)17)16(20)21-12-7-4-2-1-3-5-8-12/h12-13,15H,1-10H2/t13-,15-,17+/m0/s1