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

Systemtic Name: [(1S,2S,5S)-2-azaniumyl-5-(2-methylbutan-2-yl)cyclohexyl]-butyl-ethyl-azanium Openeye Name: [(1S,2S,5S)-2-azaniumyl-5-(1,1-dimethylpropyl)cyclohexyl]-butyl-ethyl-ammonium CAS Name: [(1S,2S,5S)-2-ammonio-5-(2-methylbutan-2-yl)cyclohexyl]-butyl-ethylammonium IUPAC Name: [(1S,2S,5S)-2-azaniumyl-5-(2-methylbutan-2-yl)cyclohexyl]-butyl-ethylazanium Traditional Name: [(1S,2S,5S)-2-ammonio-5-tert-amyl-cyclohexyl]-butyl-ethyl-ammonium Formula: C17H38N2+2 MolecularWeight: 270.49702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H36N2/c1-6-9-12-19(8-3)16-13-14(10-11-15(16)18)17(4,5)7-2/h14-16H,6-13,18H2,1-5H3/p+2/t14-,15-,16-/m0/s1