1-(3-methoxy-2-methyl-pyridin-1-ium-1-yl)butan-2-one

Systemtic Name: 1-(3-methoxy-2-methyl-pyridin-1-ium-1-yl)butan-2-one Openeye Name: 1-(3-methoxy-2-methyl-pyridin-1-ium-1-yl)butan-2-one CAS Name: 1-(3-methoxy-2-methyl-1-pyridin-1-iumyl)-2-butanone IUPAC Name: 1-(3-methoxy-2-methylpyridin-1-ium-1-yl)butan-2-one Traditional Name: 1-(3-methoxy-2-methyl-pyridin-1-ium-1-yl)butan-2-one Formula: C11H16NO2+ MolecularWeight: 194.25024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C[N+]1=CC=CC(=C1C)OC

Isomeric SMILES

CCC(=O)C[N+]1=CC=CC(=C1C)OC

InChI

InChI=1S/C11H16NO2/c1-4-10(13)8-12-7-5-6-11(14-3)9(12)2/h5-7H,4,8H2,1-3H3/q+1