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

Systemtic Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Openeye Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate CAS Name: 2-(2,4,6-trimethyl-1-pyridin-1-iumyl)propane-1,3-diol perchlorate IUPAC Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Traditional Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Formula: C11H18ClNO6 MolecularWeight: 295.71672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)C(CO)CO)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)C(CO)CO)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H18NO2.ClHO4/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;(H,2,3,4,5)/q+1;/p-1