6,6-dimethoxy-2-(phenylmethyl)-8-(phenylsulfonyl)-2-azabicyclo[2.2.2]octan-3-one

Systemtic Name: 6,6-dimethoxy-2-(phenylmethyl)-8-(phenylsulfonyl)-2-azabicyclo[2.2.2]octan-3-one Openeye Name: 8-(benzenesulfonyl)-2-benzyl-6,6-dimethoxy-2-azabicyclo[2.2.2]octan-3-one CAS Name: 8-(benzenesulfonyl)-6,6-dimethoxy-2-(phenylmethyl)-2-azabicyclo[2.2.2]octan-3-one IUPAC Name: 8-(benzenesulfonyl)-2-benzyl-6,6-dimethoxy-2-azabicyclo[2.2.2]octan-3-one Traditional Name: 2-benzyl-8-besyl-6,6-dimethoxy-2-azabicyclo[2.2.2]octan-3-one Formula: C22H25NO5S MolecularWeight: 415.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1(CC2C(CC1N(C2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1(CC2C(CC1N(C2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H25NO5S/c1-27-22(28-2)14-18-19(29(25,26)17-11-7-4-8-12-17)13-20(22)23(21(18)24)15-16-9-5-3-6-10-16/h3-12,18-20H,13-15H2,1-2H3