ethenyl (1R,6R)-5-pyridin-2-yl-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate

Systemtic Name: ethenyl (1R,6R)-5-pyridin-2-yl-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate Openeye Name: vinyl (1R,6R)-5-(2-pyridyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate CAS Name: (1R,6R)-5-(2-pyridinyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylic acid ethenyl ester IUPAC Name: ethenyl (1R,6R)-5-pyridin-2-yl-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate Traditional Name: (1R,6R)-5-(2-pyridyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylic acid vinyl ester Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

C=COC(=O)N1C2CCC=C(C1CC2)C3=CC=CC=N3

Isomeric SMILES

C=COC(=O)N1[C@@H]2CCC=C([C@H]1CC2)C3=CC=CC=N3

InChI

InChI=1S/C16H18N2O2/c1-2-20-16(19)18-12-6-5-7-13(15(18)10-9-12)14-8-3-4-11-17-14/h2-4,7-8,11-12,15H,1,5-6,9-10H2/t12-,15-/m1/s1