2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-thiophen-2-yl-ethanol bromide

Systemtic Name: 2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-thiophen-2-yl-ethanol bromide Openeye Name: 2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-(2-thienyl)ethanol bromide CAS Name: 2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-thiophen-2-ylethanol bromide IUPAC Name: 2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-thiophen-2-ylethanol bromide Traditional Name: 2-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)-1-phenyl-1-(2-thienyl)ethanol bromide Formula: C21H28BrNOS MolecularWeight: 422.42212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCC1CC(C2)CC(C3=CC=CC=C3)(C4=CC=CS4)O)C.[Br-]

Isomeric SMILES

C[N+]1(C2CCC1CC(C2)CC(C3=CC=CC=C3)(C4=CC=CS4)O)C.[Br-]

InChI

InChI=1S/C21H28NOS.BrH/c1-22(2)18-10-11-19(22)14-16(13-18)15-21(23,20-9-6-12-24-20)17-7-4-3-5-8-17;/h3-9,12,16,18-19,23H,10-11,13-15H2,1-2H3;1H/q+1;/p-1