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

Systemtic Name: ethyl (1S,2R,4R)-2-cyclohexyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate Openeye Name: ethyl (1S,2R,4R)-2-cyclohexyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate CAS Name: (1S,2R,4R)-2-cyclohexyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R,4R)-2-cyclohexyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate Traditional Name: (1S,2R,4R)-2-cyclohexyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylic acid ethyl ester Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC(C1C3CCCCC3)C=C2

Isomeric SMILES

CCOC(=O)N1[C@@H]2CC[C@H]([C@H]1C3CCCCC3)C=C2

InChI

InChI=1S/C16H25NO2/c1-2-19-16(18)17-14-10-8-13(9-11-14)15(17)12-6-4-3-5-7-12/h8,10,12-15H,2-7,9,11H2,1H3/t13-,14+,15-/m1/s1