[(2R,3S)-2-[(2S)-octan-2-yl]oxypentan-3-yl]azanium

Systemtic Name: [(2R,3S)-2-[(2S)-octan-2-yl]oxypentan-3-yl]azanium Openeye Name: [(1S,2R)-1-ethyl-2-[(1S)-1-methylheptoxy]propyl]ammonium CAS Name: [(2R,3S)-2-[(2S)-octan-2-yl]oxypentan-3-yl]ammonium IUPAC Name: [(2R,3S)-2-[(2S)-octan-2-yl]oxypentan-3-yl]azanium Traditional Name: [(1S,2R)-1-ethyl-2-[(1S)-1-methylheptoxy]propyl]ammonium Formula: C13H30NO+ MolecularWeight: 216.3834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(C)C(CC)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)O[C@H](C)[C@H](CC)[NH3+]

InChI

InChI=1S/C13H29NO/c1-5-7-8-9-10-11(3)15-12(4)13(14)6-2/h11-13H,5-10,14H2,1-4H3/p+1/t11-,12+,13-/m0/s1