2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine

Systemtic Name: 2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine Openeye Name: 2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine CAS Name: 2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine IUPAC Name: 2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine Traditional Name: 2-[3-methyl-4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)butyl]guanidine Formula: C13H29N5+2 MolecularWeight: 255.40286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCN=C(N)N)C[N+]12CC[N+](CC1)(CC2)C

Isomeric SMILES

CC(CCN=C(N)N)C[N+]12CC[N+](CC1)(CC2)C

InChI

InChI=1S/C13H29N5/c1-12(3-4-16-13(14)15)11-18-8-5-17(2,6-9-18)7-10-18/h12H,3-11H2,1-2H3,(H4,14,15,16)/q+2