2-[4-[(4-methylphenyl)methoxy]pyridin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[4-[(4-methylphenyl)methoxy]pyridin-1-ium-1-yl]ethanoate Openeye Name: 2-[4-(p-tolylmethoxy)pyridin-1-ium-1-yl]acetate CAS Name: 2-[4-[(4-methylphenyl)methoxy]-1-pyridin-1-iumyl]acetate IUPAC Name: 2-[4-[(4-methylphenyl)methoxy]pyridin-1-ium-1-yl]acetate Traditional Name: 2-[4-(4-methylbenzyl)oxypyridin-1-ium-1-yl]acetate Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=[N+](C=C2)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=[N+](C=C2)CC(=O)[O-]

InChI

InChI=1S/C15H15NO3/c1-12-2-4-13(5-3-12)11-19-14-6-8-16(9-7-14)10-15(17)18/h2-9H,10-11H2,1H3