(phenylmethyl) 4-(pyridin-3-yloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylate

Systemtic Name: (phenylmethyl) 4-(pyridin-3-yloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylate Openeye Name: benzyl 4-(3-pyridyloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylate CAS Name: 4-(3-pyridinyloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(pyridin-3-yloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylate Traditional Name: 4-(3-pyridyloxymethyl)-3-azabicyclo[2.1.1]hexane-3-carboxylic acid benzyl ester Formula: C19H20N2O3 MolecularWeight: 324.3737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC1(N(C2)C(=O)OCC3=CC=CC=C3)COC4=CN=CC=C4

Isomeric SMILES

C1C2CC1(N(C2)C(=O)OCC3=CC=CC=C3)COC4=CN=CC=C4

InChI

InChI=1S/C19H20N2O3/c22-18(23-13-15-5-2-1-3-6-15)21-12-16-9-19(21,10-16)14-24-17-7-4-8-20-11-17/h1-8,11,16H,9-10,12-14H2