[2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-2-ethyl-butyl]azanium

Systemtic Name: [2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-2-ethyl-butyl]azanium Openeye Name: [2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-2-ethyl-butyl]ammonium CAS Name: [2-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]-2-ethylbutyl]ammonium IUPAC Name: [2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-2-ethylbutyl]azanium Traditional Name: [2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-2-ethyl-butyl]ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C[NH3+])[NH+]1CC(CC(C1)C)C

Isomeric SMILES

CCC(CC)(C[NH3+])[NH+]1C[C@H](C[C@@H](C1)C)C

InChI

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