2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol tetrafluoroborate

Systemtic Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol tetrafluoroborate Openeye Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol tetrafluoroborate CAS Name: 2-(2,4,6-trimethyl-1-pyridin-1-iumyl)propane-1,3-diol tetrafluoroborate IUPAC Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol tetrafluoroborate Traditional Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol tetrafluoroborate Formula: C11H18BF4NO2 MolecularWeight: 283.070733

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC(=[N+](C(=C1)C)C(CO)CO)C

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC(=[N+](C(=C1)C)C(CO)CO)C

InChI

InChI=1S/C11H18NO2.BF4/c1-8-4-9(2)12(10(3)5-8)11(6-13)7-14;2-1(3,4)5/h4-5,11,13-14H,6-7H2,1-3H3;/q+1;-1