2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-5-phenyl-3-sulfanyl-pentanoic acid

Systemtic Name: 2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-5-phenyl-3-sulfanyl-pentanoic acid Openeye Name: 2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-5-phenyl-3-sulfanyl-pentanoic acid CAS Name: 2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-3-mercapto-5-phenylpentanoic acid IUPAC Name: 2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-5-phenyl-3-sulfanylpentanoic acid Traditional Name: 2-(3-azabicyclo[3.2.1]octan-8-ylmethyl)-3-mercapto-5-phenyl-valeric acid Formula: C19H27NO2S MolecularWeight: 333.48818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNCC1C2CC(C(CCC3=CC=CC=C3)S)C(=O)O

Isomeric SMILES

C1CC2CNCC1C2CC(C(CCC3=CC=CC=C3)S)C(=O)O

InChI

InChI=1S/C19H27NO2S/c21-19(22)17(10-16-14-7-8-15(16)12-20-11-14)18(23)9-6-13-4-2-1-3-5-13/h1-5,14-18,20,23H,6-12H2,(H,21,22)