tert-butyl 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylate

Systemtic Name: tert-butyl 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylate Openeye Name: tert-butyl 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylate CAS Name: 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylate Traditional Name: 2-aza-1-azoniabicyclo[2.2.2]octane-1-carboxylic acid tert-butyl ester Formula: C11H21N2O2+ MolecularWeight: 213.29664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]12CCC(CC1)CN2

Isomeric SMILES

CC(C)(C)OC(=O)[N+]12CCC(CC1)CN2

InChI

InChI=1S/C11H21N2O2/c1-11(2,3)15-10(14)13-6-4-9(5-7-13)8-12-13/h9,12H,4-8H2,1-3H3/q+1