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

Systemtic Name: [(3R,4R)-3-(2-butoxyethoxy)heptan-4-yl]azanium Openeye Name: [(1R,2R)-2-(2-butoxyethoxy)-1-propyl-butyl]ammonium CAS Name: [(3R,4R)-3-(2-butoxyethoxy)heptan-4-yl]ammonium IUPAC Name: [(3R,4R)-3-(2-butoxyethoxy)heptan-4-yl]azanium Traditional Name: [(1R,2R)-2-(2-butoxyethoxy)-1-propyl-butyl]ammonium Formula: C13H30NO2+ MolecularWeight: 232.3828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC(CC)C(CCC)[NH3+]

Isomeric SMILES

CCCCOCCO[C@H](CC)[C@@H](CCC)[NH3+]

InChI

InChI=1S/C13H29NO2/c1-4-7-9-15-10-11-16-13(6-3)12(14)8-5-2/h12-13H,4-11,14H2,1-3H3/p+1/t12-,13-/m1/s1