2-(4-butan-2-ylpyridin-1-ium-1-yl)-2-methyl-3-methylperoxy-propanoic acid

Systemtic Name: 2-(4-butan-2-ylpyridin-1-ium-1-yl)-2-methyl-3-methylperoxy-propanoic acid Openeye Name: 2-methyl-3-methylperoxy-2-(4-sec-butylpyridin-1-ium-1-yl)propanoic acid CAS Name: 2-(4-butan-2-yl-1-pyridin-1-iumyl)-2-methyl-3-methyldioxypropanoic acid IUPAC Name: 2-(4-butan-2-ylpyridin-1-ium-1-yl)-2-methyl-3-methylperoxypropanoic acid Traditional Name: 2-methyl-3-methylperoxy-2-(4-sec-butylpyridin-1-ium-1-yl)propionic acid Formula: C14H22NO4+ MolecularWeight: 268.32878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=[N+](C=C1)C(C)(COOC)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=[N+](C=C1)C(C)(COOC)C(=O)O

InChI

InChI=1S/C14H21NO4/c1-5-11(2)12-6-8-15(9-7-12)14(3,13(16)17)10-19-18-4/h6-9,11H,5,10H2,1-4H3/p+1