[(3R)-3-(4-propylpiperazin-4-ium-1-yl)-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium

Systemtic Name: [(3R)-3-(4-propylpiperazin-4-ium-1-yl)-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium Openeye Name: [(3R)-3-(4-propylpiperazin-4-ium-1-yl)quinuclidin-1-ium-3-yl]methylammonium CAS Name: [(3R)-3-(4-propyl-1-piperazin-4-iumyl)-1-azoniabicyclo[2.2.2]octan-3-yl]methylammonium IUPAC Name: [(3R)-3-(4-propylpiperazin-4-ium-1-yl)-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium Traditional Name: [(3R)-3-(4-propylpiperazin-4-ium-1-yl)quinuclidin-1-ium-3-yl]methylammonium Formula: C15H33N4+3 MolecularWeight: 269.44932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2(C[NH+]3CCC2CC3)C[NH3+]

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@@]2(C[NH+]3CCC2CC3)C[NH3+]

InChI

InChI=1S/C15H30N4/c1-2-5-17-8-10-19(11-9-17)15(12-16)13-18-6-3-14(15)4-7-18/h14H,2-13,16H2,1H3/p+3/t15-/m1/s1