3-(2,4,6-trimethylpyridin-1-ium-1-yl)propanoate

Systemtic Name: 3-(2,4,6-trimethylpyridin-1-ium-1-yl)propanoate Openeye Name: 3-(2,4,6-trimethylpyridin-1-ium-1-yl)propanoate CAS Name: 3-(2,4,6-trimethyl-1-pyridin-1-iumyl)propanoate IUPAC Name: 3-(2,4,6-trimethylpyridin-1-ium-1-yl)propanoate Traditional Name: 3-(2,4,6-trimethylpyridin-1-ium-1-yl)propionate Formula: C11H15NO2 MolecularWeight: 193.2423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO2/c1-8-6-9(2)12(10(3)7-8)5-4-11(13)14/h6-7H,4-5H2,1-3H3