[(3R,4S)-3-[(2S)-2-ethylhexoxy]heptan-4-yl]azanium

Systemtic Name: [(3R,4S)-3-[(2S)-2-ethylhexoxy]heptan-4-yl]azanium Openeye Name: [(1S,2R)-2-[(2S)-2-ethylhexoxy]-1-propyl-butyl]ammonium CAS Name: [(3R,4S)-3-[(2S)-2-ethylhexoxy]heptan-4-yl]ammonium IUPAC Name: [(3R,4S)-3-[(2S)-2-ethylhexoxy]heptan-4-yl]azanium Traditional Name: [(1S,2R)-2-[(2S)-2-ethylhexoxy]-1-propyl-butyl]ammonium Formula: C15H34NO+ MolecularWeight: 244.43656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(CC)C(CCC)[NH3+]

Isomeric SMILES

CCCC[C@H](CC)CO[C@H](CC)[C@H](CCC)[NH3+]

InChI

InChI=1S/C15H33NO/c1-5-9-11-13(7-3)12-17-15(8-4)14(16)10-6-2/h13-15H,5-12,16H2,1-4H3/p+1/t13-,14-,15+/m0/s1