(4,6-dimethyl-1-oxidanyl-pyridin-1-ium-2-yl)methyl ethanoate

Systemtic Name: (4,6-dimethyl-1-oxidanyl-pyridin-1-ium-2-yl)methyl ethanoate Openeye Name: (1-hydroxy-4,6-dimethyl-pyridin-1-ium-2-yl)methyl acetate CAS Name: acetic acid (1-hydroxy-4,6-dimethyl-2-pyridin-1-iumyl)methyl ester IUPAC Name: (1-hydroxy-4,6-dimethylpyridin-1-ium-2-yl)methyl acetate Traditional Name: acetic acid (1-hydroxy-4,6-dimethyl-pyridin-1-ium-2-yl)methyl ester Formula: C10H14NO3+ MolecularWeight: 196.22306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14NO3/c1-7-4-8(2)11(13)10(5-7)6-14-9(3)12/h4-5,13H,6H2,1-3H3/q+1