3-[5-(3-methoxyphenyl)sulfonylpyridin-3-yl]-3,6-diazabicyclo[3.2.1]octane

Systemtic Name: 3-[5-(3-methoxyphenyl)sulfonylpyridin-3-yl]-3,6-diazabicyclo[3.2.1]octane Openeye Name: 3-[5-(3-methoxyphenyl)sulfonyl-3-pyridyl]-3,6-diazabicyclo[3.2.1]octane CAS Name: 3-[5-(3-methoxyphenyl)sulfonyl-3-pyridinyl]-3,6-diazabicyclo[3.2.1]octane IUPAC Name: 3-[5-(3-methoxyphenyl)sulfonylpyridin-3-yl]-3,6-diazabicyclo[3.2.1]octane Traditional Name: 3-[5-(3-methoxyphenyl)sulfonyl-3-pyridyl]-3,6-diazabicyclo[3.2.1]octane Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)C2=CN=CC(=C2)N3CC4CC(C3)NC4

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)C2=CN=CC(=C2)N3CC4CC(C3)NC4

InChI

InChI=1S/C18H21N3O3S/c1-24-16-3-2-4-17(7-16)25(22,23)18-6-15(9-19-10-18)21-11-13-5-14(12-21)20-8-13/h2-4,6-7,9-10,13-14,20H,5,8,11-12H2,1H3