(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(phenylsulfinyl)propanoate

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(phenylsulfinyl)propanoate Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(benzenesulfinyl)propanoate CAS Name: 2-(benzenesulfinyl)propanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(benzenesulfinyl)propanoate Traditional Name: 2-(benzenesulfinyl)propionic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Formula: C17H23NO3S MolecularWeight: 321.43442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CC2CCC(C1)N2C)S(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC1CC2CCC(C1)N2C)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H23NO3S/c1-12(22(20)16-6-4-3-5-7-16)17(19)21-15-10-13-8-9-14(11-15)18(13)2/h3-7,12-15H,8-11H2,1-2H3