[(1S,2S,5S)-2-azaniumyl-5-methyl-cyclohexyl]-butyl-ethyl-azanium

Systemtic Name: [(1S,2S,5S)-2-azaniumyl-5-methyl-cyclohexyl]-butyl-ethyl-azanium Openeye Name: [(1S,2S,5S)-2-azaniumyl-5-methyl-cyclohexyl]-butyl-ethyl-ammonium CAS Name: [(1S,2S,5S)-2-ammonio-5-methylcyclohexyl]-butyl-ethylammonium IUPAC Name: [(1S,2S,5S)-2-azaniumyl-5-methylcyclohexyl]-butyl-ethylazanium Traditional Name: [(1S,2S,5S)-2-ammonio-5-methyl-cyclohexyl]-butyl-ethyl-ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C1CC(CCC1[NH3+])C

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2/c1-4-6-9-15(5-2)13-10-11(3)7-8-12(13)14/h11-13H,4-10,14H2,1-3H3/p+2/t11-,12-,13-/m0/s1