3-methyl-2-(pyridin-1-ium-4-ylmethyl)-2H-furan-5-one

Systemtic Name: 3-methyl-2-(pyridin-1-ium-4-ylmethyl)-2H-furan-5-one Openeye Name: 3-methyl-2-(pyridin-1-ium-4-ylmethyl)-2H-furan-5-one CAS Name: 3-methyl-2-(4-pyridin-1-iumylmethyl)-2H-furan-5-one IUPAC Name: 3-methyl-2-(pyridin-1-ium-4-ylmethyl)-2H-furan-5-one Traditional Name: 3-methyl-2-(pyridin-1-ium-4-ylmethyl)-2H-furan-5-one Formula: C11H12NO2+ MolecularWeight: 190.21848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2/c1-8-6-11(13)14-10(8)7-9-2-4-12-5-3-9/h2-6,10H,7H2,1H3/p+1