5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylazanium

Systemtic Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylazanium Openeye Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylammonium CAS Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylammonium IUPAC Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylazanium Traditional Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentyliminomethylammonium Formula: C13H29N4+3 MolecularWeight: 241.39616

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CC[N+](CC1)(CC2)CCCCCN=C[NH3+]

Isomeric SMILES

C[N+]12CC[N+](CC1)(CC2)CCCCCN=C[NH3+]

InChI

InChI=1S/C13H28N4/c1-16-7-10-17(11-8-16,12-9-16)6-4-2-3-5-15-13-14/h13H,2-12H2,1H3,(H2,14,15)/q+2/p+1