[8-(4-cyanonaphthalen-1-yl)-8-azabicyclo[3.2.1]octan-3-yl] 3-morpholin-4-ylpropanoate

Systemtic Name: [8-(4-cyanonaphthalen-1-yl)-8-azabicyclo[3.2.1]octan-3-yl] 3-morpholin-4-ylpropanoate Openeye Name: [8-(4-cyano-1-naphthyl)-8-azabicyclo[3.2.1]octan-3-yl] 3-morpholinopropanoate CAS Name: 3-(4-morpholinyl)propanoic acid [8-(4-cyano-1-naphthalenyl)-8-azabicyclo[3.2.1]octan-3-yl] ester IUPAC Name: [8-(4-cyanonaphthalen-1-yl)-8-azabicyclo[3.2.1]octan-3-yl] 3-morpholin-4-ylpropanoate Traditional Name: 3-morpholinopropionic acid [8-(4-cyano-1-naphthyl)-8-azabicyclo[3.2.1]octan-3-yl] ester Formula: C25H29N3O3 MolecularWeight: 419.51606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C3=CC=C(C4=CC=CC=C43)C#N)OC(=O)CCN5CCOCC5

Isomeric SMILES

C1CC2CC(CC1N2C3=CC=C(C4=CC=CC=C43)C#N)OC(=O)CCN5CCOCC5

InChI

InChI=1S/C25H29N3O3/c26-17-18-5-8-24(23-4-2-1-3-22(18)23)28-19-6-7-20(28)16-21(15-19)31-25(29)9-10-27-11-13-30-14-12-27/h1-5,8,19-21H,6-7,9-16H2