methyl (1R,4R,8S)-8-chloranyl-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate

Systemtic Name: methyl (1R,4R,8S)-8-chloranyl-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate Openeye Name: methyl (1R,4R,8S)-8-chloro-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate CAS Name: (1R,4R,8S)-8-chloro-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid methyl ester IUPAC Name: methyl (1R,4R,8S)-8-chloro-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate Traditional Name: (1R,4R,8S)-8-chloro-3-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid methyl ester Formula: C11H16ClNO2 MolecularWeight: 229.70324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2CC(C1NC2)(C(=O)OC)Cl

Isomeric SMILES

CCC1=C[C@H]2C[C@]([C@@H]1NC2)(C(=O)OC)Cl

InChI

InChI=1S/C11H16ClNO2/c1-3-8-4-7-5-11(12,10(14)15-2)9(8)13-6-7/h4,7,9,13H,3,5-6H2,1-2H3/t7-,9+,11-/m0/s1