4-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoic acid

Systemtic Name: 4-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoic acid Openeye Name: 4-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoic acid CAS Name: 4-(2,4,6-trimethyl-1-pyridin-1-iumyl)butanoic acid IUPAC Name: 4-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoic acid Traditional Name: 4-(2,4,6-trimethylpyridin-1-ium-1-yl)butyric acid Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)CCCC(=O)O)C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)CCCC(=O)O)C

InChI

InChI=1S/C12H17NO2/c1-9-7-10(2)13(11(3)8-9)6-4-5-12(14)15/h7-8H,4-6H2,1-3H3/p+1