4-(4-bromophenyl)sulfonyl-4-aza-1-azoniabicyclo[3.2.2]nonane

Systemtic Name: 4-(4-bromophenyl)sulfonyl-4-aza-1-azoniabicyclo[3.2.2]nonane Openeye Name: 4-(4-bromophenyl)sulfonyl-4-aza-1-azoniabicyclo[3.2.2]nonane CAS Name: 4-(4-bromophenyl)sulfonyl-4-aza-1-azoniabicyclo[3.2.2]nonane IUPAC Name: 4-(4-bromophenyl)sulfonyl-4-aza-1-azoniabicyclo[3.2.2]nonane Traditional Name: 4-brosyl-4-aza-1-azoniabicyclo[3.2.2]nonane Formula: C13H18BrN2O2S+ MolecularWeight: 346.26322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1N(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH+]2CCC1N(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H17BrN2O2S/c14-11-1-3-13(4-2-11)19(17,18)16-10-9-15-7-5-12(16)6-8-15/h1-4,12H,5-10H2/p+1