3-(1-methylpyrrolidin-1-ium-1-yl)-3H-2-benzofuran-1-one

Systemtic Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-3H-2-benzofuran-1-one Openeye Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-3H-isobenzofuran-1-one CAS Name: 3-(1-methyl-1-pyrrolidin-1-iumyl)-3H-isobenzofuran-1-one IUPAC Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-3H-2-benzofuran-1-one Traditional Name: 3-(1-methylpyrrolidin-1-ium-1-yl)phthalide Formula: C13H16NO2+ MolecularWeight: 218.27164

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)C2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

C[N+]1(CCCC1)C2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C13H16NO2/c1-14(8-4-5-9-14)12-10-6-2-3-7-11(10)13(15)16-12/h2-3,6-7,12H,4-5,8-9H2,1H3/q+1