4-(3-imidazol-1-ylpropyl)-1-aza-4-azoniabicyclo[2.2.2]octane

Systemtic Name: 4-(3-imidazol-1-ylpropyl)-1-aza-4-azoniabicyclo[2.2.2]octane Openeye Name: 4-(3-imidazol-1-ylpropyl)-1-aza-4-azoniabicyclo[2.2.2]octane CAS Name: 4-[3-(1-imidazolyl)propyl]-1-aza-4-azoniabicyclo[2.2.2]octane IUPAC Name: 4-(3-imidazol-1-ylpropyl)-1-aza-4-azoniabicyclo[2.2.2]octane Traditional Name: 4-(3-imidazol-1-ylpropyl)-1-aza-4-azoniabicyclo[2.2.2]octane Formula: C12H21N4+ MolecularWeight: 221.32194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN1CC2)CCCN3C=CN=C3

Isomeric SMILES

C1C[N+]2(CCN1CC2)CCCN3C=CN=C3

InChI

InChI=1S/C12H21N4/c1(3-15-4-2-13-12-15)8-16-9-5-14(6-10-16)7-11-16/h2,4,12H,1,3,5-11H2/q+1