[3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] 3-cyclopentylpropanoate

Systemtic Name: [3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] 3-cyclopentylpropanoate Openeye Name: [3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] 3-cyclopentylpropanoate CAS Name: 3-cyclopentylpropanoic acid [3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] ester IUPAC Name: [3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] 3-cyclopentylpropanoate Traditional Name: 3-cyclopentylpropionic acid [3-(9-methoxy-3-phenethyl-3-azabicyclo[3.3.1]nonan-9-yl)phenyl] ester Formula: C31H41NO3 MolecularWeight: 475.66214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1(C2CCCC1CN(C2)CCC3=CC=CC=C3)C4=CC(=CC=C4)OC(=O)CCC5CCCC5

Isomeric SMILES

COC1(C2CCCC1CN(C2)CCC3=CC=CC=C3)C4=CC(=CC=C4)OC(=O)CCC5CCCC5

InChI

InChI=1S/C31H41NO3/c1-34-31(26-13-8-16-29(21-26)35-30(33)18-17-24-11-5-6-12-24)27-14-7-15-28(31)23-32(22-27)20-19-25-9-3-2-4-10-25/h2-4,8-10,13,16,21,24,27-28H,5-7,11-12,14-15,17-20,22-23H2,1H3