2-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-1-ol perchlorate

Systemtic Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-1-ol perchlorate Openeye Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-1-ol perchlorate CAS Name: 2-(2,4,6-trimethyl-1-pyridin-1-iumyl)-1-butanol perchlorate IUPAC Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-1-ol perchlorate Traditional Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-1-ol perchlorate Formula: C12H20ClNO5 MolecularWeight: 293.7439

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[N+]1=C(C=C(C=C1C)C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC(CO)[N+]1=C(C=C(C=C1C)C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H20NO.ClHO4/c1-5-12(8-14)13-10(3)6-9(2)7-11(13)4;2-1(3,4)5/h6-7,12,14H,5,8H2,1-4H3;(H,2,3,4,5)/q+1;/p-1