[(1S,2S)-2-azaniumylcycloheptyl]-butyl-ethyl-azanium

Systemtic Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-ethyl-azanium Openeye Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-ethyl-ammonium CAS Name: [(1S,2S)-2-ammoniocycloheptyl]-butyl-ethylammonium IUPAC Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-ethylazanium Traditional Name: [(1S,2S)-2-ammoniocycloheptyl]-butyl-ethyl-ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C1CCCCCC1[NH3+]

Isomeric SMILES

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

InChI

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