[(1S,2S)-2-azaniumylcyclooctyl]-butyl-methyl-azanium

Systemtic Name: [(1S,2S)-2-azaniumylcyclooctyl]-butyl-methyl-azanium Openeye Name: [(1S,2S)-2-azaniumylcyclooctyl]-butyl-methyl-ammonium CAS Name: [(1S,2S)-2-ammoniocyclooctyl]-butyl-methylammonium IUPAC Name: [(1S,2S)-2-azaniumylcyclooctyl]-butyl-methylazanium Traditional Name: [(1S,2S)-2-ammoniocyclooctyl]-butyl-methyl-ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CCCCCCC1[NH3+]

Isomeric SMILES

CCCC[NH+](C)[C@H]1CCCCCC[C@@H]1[NH3+]

InChI

InChI=1S/C13H28N2/c1-3-4-11-15(2)13-10-8-6-5-7-9-12(13)14/h12-13H,3-11,14H2,1-2H3/p+2/t12-,13-/m0/s1