methyl (1S,5S,6S)-3-chloranyl-2-cyano-bicyclo[3.2.1]oct-2-ene-6-carboxylate

Systemtic Name: methyl (1S,5S,6S)-3-chloranyl-2-cyano-bicyclo[3.2.1]oct-2-ene-6-carboxylate Openeye Name: methyl (1S,5S,6S)-3-chloro-2-cyano-bicyclo[3.2.1]oct-2-ene-6-carboxylate CAS Name: (1S,5S,6S)-3-chloro-2-cyano-6-bicyclo[3.2.1]oct-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,5S,6S)-3-chloro-2-cyanobicyclo[3.2.1]oct-2-ene-6-carboxylate Traditional Name: (1S,5S,6S)-3-chloro-2-cyano-bicyclo[3.2.1]oct-2-ene-6-carboxylic acid methyl ester Formula: C11H12ClNO2 MolecularWeight: 225.67148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2CC1CC(=C2C#N)Cl

Isomeric SMILES

COC(=O)[C@H]1C[C@@H]2C[C@H]1CC(=C2C#N)Cl

InChI

InChI=1S/C11H12ClNO2/c1-15-11(14)8-3-6-2-7(8)4-10(12)9(6)5-13/h6-8H,2-4H2,1H3/t6-,7-,8-/m0/s1