(phenylmethyl) (1S,5R,6R)-6-cyano-4-oxidanylidene-bicyclo[3.1.0]hexane-6-carboxylate

Systemtic Name: (phenylmethyl) (1S,5R,6R)-6-cyano-4-oxidanylidene-bicyclo[3.1.0]hexane-6-carboxylate Openeye Name: benzyl (1S,5R,6R)-6-cyano-4-oxo-bicyclo[3.1.0]hexane-6-carboxylate CAS Name: (1S,5R,6R)-6-cyano-4-oxo-6-bicyclo[3.1.0]hexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,5R,6R)-6-cyano-4-oxobicyclo[3.1.0]hexane-6-carboxylate Traditional Name: (1S,5R,6R)-6-cyano-4-keto-bicyclo[3.1.0]hexane-6-carboxylic acid benzyl ester Formula: C15H13NO3 MolecularWeight: 255.26862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2C1C2(C#N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)[C@@H]2[C@H]1[C@@]2(C#N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C15H13NO3/c16-9-15(11-6-7-12(17)13(11)15)14(18)19-8-10-4-2-1-3-5-10/h1-5,11,13H,6-8H2/t11-,13-,15+/m0/s1