2-azaniumyl-6-(2,4,6-trimethylpyridin-1-ium-1-yl)hexanoate perchlorate

Systemtic Name: 2-azaniumyl-6-(2,4,6-trimethylpyridin-1-ium-1-yl)hexanoate perchlorate Openeye Name: 2-azaniumyl-6-(2,4,6-trimethylpyridin-1-ium-1-yl)hexanoate perchlorate CAS Name: 2-ammonio-6-(2,4,6-trimethyl-1-pyridin-1-iumyl)hexanoate perchlorate IUPAC Name: 2-azaniumyl-6-(2,4,6-trimethylpyridin-1-ium-1-yl)hexanoate perchlorate Traditional Name: 2-ammonio-6-(2,4,6-trimethylpyridin-1-ium-1-yl)hexanoate perchlorate Formula: C14H23ClN2O6 MolecularWeight: 350.79522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)CCCCC(C(=O)[O-])[NH3+])C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)CCCCC(C(=O)[O-])[NH3+])C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H22N2O2.ClHO4/c1-10-8-11(2)16(12(3)9-10)7-5-4-6-13(15)14(17)18;2-1(3,4)5/h8-9,13H,4-7,15H2,1-3H3;(H,2,3,4,5)