(3R)-N-(4-bromanyl-2-methyl-phenyl)-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3R)-N-(4-bromanyl-2-methyl-phenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3R)-N-(4-bromo-2-methyl-phenyl)quinuclidin-1-ium-3-amine CAS Name: (3R)-N-(4-bromo-2-methylphenyl)-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3R)-N-(4-bromo-2-methylphenyl)-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: (4-bromo-2-methyl-phenyl)-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C14H20BrN2+ MolecularWeight: 296.226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC2C[NH+]3CCC2CC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N[C@H]2C[NH+]3CCC2CC3

InChI

InChI=1S/C14H19BrN2/c1-10-8-12(15)2-3-13(10)16-14-9-17-6-4-11(14)5-7-17/h2-3,8,11,14,16H,4-7,9H2,1H3/p+1/t14-/m0/s1