(2S)-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-bromanyl-3-methyl-butanamide

Systemtic Name: (2S)-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-bromanyl-3-methyl-butanamide Openeye Name: (2S)-2-bromo-3-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]butanamide CAS Name: (2S)-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-bromo-3-methylbutanamide IUPAC Name: (2S)-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-bromo-3-methylbutanamide Traditional Name: (2S)-2-bromo-3-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]butyramide Formula: C12H22BrN2O+ MolecularWeight: 290.21988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1C[NH+]2CCC1CC2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@H]1C[NH+]2CCC1CC2)Br

InChI

InChI=1S/C12H21BrN2O/c1-8(2)11(13)12(16)14-10-7-15-5-3-9(10)4-6-15/h8-11H,3-7H2,1-2H3,(H,14,16)/p+1/t10-,11-/m0/s1