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

Systemtic Name: 1-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-2-one perchlorate Openeye Name: 1-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-2-one perchlorate CAS Name: 1-(2,4,6-trimethyl-1-pyridin-1-iumyl)-2-butanone perchlorate IUPAC Name: 1-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-2-one perchlorate Traditional Name: 1-(2,4,6-trimethylpyridin-1-ium-1-yl)butan-2-one perchlorate Formula: C12H18ClNO5 MolecularWeight: 291.72802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18NO.ClHO4/c1-5-12(14)8-13-10(3)6-9(2)7-11(13)4;2-1(3,4)5/h6-7H,5,8H2,1-4H3;(H,2,3,4,5)/q+1;/p-1