diethyl (1R,5S,6R)-6-cyano-4-methylidene-bicyclo[3.2.1]octane-2,2-dicarboxylate

Systemtic Name: diethyl (1R,5S,6R)-6-cyano-4-methylidene-bicyclo[3.2.1]octane-2,2-dicarboxylate Openeye Name: diethyl (1R,5S,6R)-6-cyano-4-methylene-bicyclo[3.2.1]octane-2,2-dicarboxylate CAS Name: (1R,5S,6R)-6-cyano-4-methylenebicyclo[3.2.1]octane-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1R,5S,6R)-6-cyano-4-methylidenebicyclo[3.2.1]octane-2,2-dicarboxylate Traditional Name: (1R,5S,6R)-6-cyano-4-methylene-bicyclo[3.2.1]octane-2,2-dicarboxylic acid diethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(=C)C2CC1CC2C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(=C)[C@H]2C[C@@H]1C[C@H]2C#N)C(=O)OCC

InChI

InChI=1S/C16H21NO4/c1-4-20-14(18)16(15(19)21-5-2)8-10(3)13-7-12(16)6-11(13)9-17/h11-13H,3-8H2,1-2H3/t11-,12-,13+/m0/s1