2-[[2-ethyl-2-[(4-hexadecan-5-yl-1,2-oxazol-3-yl)oxy]-5H-1,2-oxazol-2-ium-3-yl]oxy]propyl methanoate

Systemtic Name: 2-[[2-ethyl-2-[(4-hexadecan-5-yl-1,2-oxazol-3-yl)oxy]-5H-1,2-oxazol-2-ium-3-yl]oxy]propyl methanoate Openeye Name: 2-[[2-[4-(1-butyldodecyl)isoxazol-3-yl]oxy-2-ethyl-5H-isoxazol-2-ium-3-yl]oxy]propyl formate CAS Name: formic acid 2-[[2-ethyl-2-[(4-hexadecan-5-yl-3-isoxazolyl)oxy]-5H-isoxazol-2-ium-3-yl]oxy]propyl ester IUPAC Name: 2-[[2-ethyl-2-[(4-hexadecan-5-yl-1,2-oxazol-3-yl)oxy]-5H-1,2-oxazol-2-ium-3-yl]oxy]propyl formate Traditional Name: formic acid 2-[[2-[4-(1-butyldodecyl)isoxazol-3-yl]oxy-2-ethyl-3-isoxazolin-2-ium-3-yl]oxy]propyl ester Formula: C28H49N2O6+ MolecularWeight: 509.69846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCC)C1=CON=C1O[N+]2(C(=CCO2)OC(C)COC=O)CC

Isomeric SMILES

CCCCCCCCCCCC(CCCC)C1=CON=C1O[N+]2(C(=CCO2)OC(C)COC=O)CC

InChI

InChI=1S/C28H49N2O6/c1-5-8-10-11-12-13-14-15-16-18-25(17-9-6-2)26-22-33-29-28(26)36-30(7-3)27(19-20-34-30)35-24(4)21-32-23-31/h19,22-25H,5-18,20-21H2,1-4H3/q+1