3,3-dimethyl-1-(1-oxidanylpyridin-1-ium-4-yl)butan-2-one

Systemtic Name: 3,3-dimethyl-1-(1-oxidanylpyridin-1-ium-4-yl)butan-2-one Openeye Name: 1-(1-hydroxypyridin-1-ium-4-yl)-3,3-dimethyl-butan-2-one CAS Name: 1-(1-hydroxy-4-pyridin-1-iumyl)-3,3-dimethyl-2-butanone IUPAC Name: 1-(1-hydroxypyridin-1-ium-4-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-(1-hydroxypyridin-1-ium-4-yl)-3,3-dimethyl-butan-2-one Formula: C11H16NO2+ MolecularWeight: 194.25024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16NO2/c1-11(2,3)10(13)8-9-4-6-12(14)7-5-9/h4-7,14H,8H2,1-3H3/q+1