2-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate

Systemtic Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate Openeye Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate CAS Name: 2-(2,4,6-trimethyl-1-pyridin-1-iumyl)benzoate IUPAC Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate Traditional Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)benzoate Formula: C15H15NO2 MolecularWeight: 241.2851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)C2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)C2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C15H15NO2/c1-10-8-11(2)16(12(3)9-10)14-7-5-4-6-13(14)15(17)18/h4-9H,1-3H3