3-(2-nitrophenyl)sulfanyl-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-(2-nitrophenyl)sulfanyl-1-azabicyclo[2.2.2]octane Openeye Name: 3-(2-nitrophenyl)sulfanylquinuclidine CAS Name: 3-[(2-nitrophenyl)thio]-1-azabicyclo[2.2.2]octane IUPAC Name: 3-(2-nitrophenyl)sulfanyl-1-azabicyclo[2.2.2]octane Traditional Name: 3-[(2-nitrophenyl)thio]quinuclidine Formula: C13H16N2O2S MolecularWeight: 264.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN2CCC1C(C2)SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O2S/c16-15(17)11-3-1-2-4-12(11)18-13-9-14-7-5-10(13)6-8-14/h1-4,10,13H,5-9H2