ethyl (1S,5R)-3-pyridin-3-yl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate

Systemtic Name: ethyl (1S,5R)-3-pyridin-3-yl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Openeye Name: ethyl (1S,5R)-3-(3-pyridyl)-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate CAS Name: (1S,5R)-3-(3-pyridinyl)-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,5R)-3-pyridin-3-yl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Traditional Name: (1S,5R)-3-(3-pyridyl)-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid ethyl ester Formula: C15H18N2O2 MolecularWeight: 258.31562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC1C=C(C2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)N1[C@H]2CC[C@@H]1C=C(C2)C3=CN=CC=C3

InChI

InChI=1S/C15H18N2O2/c1-2-19-15(18)17-13-5-6-14(17)9-12(8-13)11-4-3-7-16-10-11/h3-4,7-8,10,13-14H,2,5-6,9H2,1H3/t13-,14+/m1/s1