3,3,5-trimethyl-7-(6-phenoxypyridin-3-yl)sulfonyl-7-azabicyclo[3.2.1]octane

Systemtic Name: 3,3,5-trimethyl-7-(6-phenoxypyridin-3-yl)sulfonyl-7-azabicyclo[3.2.1]octane Openeye Name: 3,3,5-trimethyl-7-[(6-phenoxy-3-pyridyl)sulfonyl]-7-azabicyclo[3.2.1]octane CAS Name: 3,3,5-trimethyl-7-[(6-phenoxy-3-pyridinyl)sulfonyl]-7-azabicyclo[3.2.1]octane IUPAC Name: 3,3,5-trimethyl-7-(6-phenoxypyridin-3-yl)sulfonyl-7-azabicyclo[3.2.1]octane Traditional Name: 3,3,5-trimethyl-7-[(6-phenoxy-3-pyridyl)sulfonyl]-7-azabicyclo[3.2.1]octane Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2S(=O)(=O)C3=CN=C(C=C3)OC4=CC=CC=C4)C)C

Isomeric SMILES

CC1(CC2CC(C1)(CN2S(=O)(=O)C3=CN=C(C=C3)OC4=CC=CC=C4)C)C

InChI

InChI=1S/C21H26N2O3S/c1-20(2)11-16-12-21(3,14-20)15-23(16)27(24,25)18-9-10-19(22-13-18)26-17-7-5-4-6-8-17/h4-10,13,16H,11-12,14-15H2,1-3H3