3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methyl]-2H-furan-5-one

Systemtic Name: 3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methyl]-2H-furan-5-one Openeye Name: 3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methyl]-2H-furan-5-one CAS Name: 3-methyl-2-[(1-methyl-4-pyridin-1-iumyl)methyl]-2H-furan-5-one IUPAC Name: 3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methyl]-2H-furan-5-one Traditional Name: 3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methyl]-2H-furan-5-one Formula: C12H14NO2+ MolecularWeight: 204.24506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC1CC2=CC=[N+](C=C2)C

Isomeric SMILES

CC1=CC(=O)OC1CC2=CC=[N+](C=C2)C

InChI

InChI=1S/C12H14NO2/c1-9-7-12(14)15-11(9)8-10-3-5-13(2)6-4-10/h3-7,11H,8H2,1-2H3/q+1