5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pent-1-en-2-ylazanium

Systemtic Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pent-1-en-2-ylazanium Openeye Name: [4-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)-1-methylene-butyl]ammonium CAS Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pent-1-en-2-ylammonium IUPAC Name: 5-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pent-1-en-2-ylazanium Traditional Name: 1-[3-(1-methyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)propyl]vinylammonium Formula: C12H26N3+3 MolecularWeight: 212.35494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25N3/c1-12(13)4-3-5-15-9-6-14(2,7-10-15)8-11-15/h1,3-11,13H2,2H3/q+2/p+1