1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanone Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C17H16NO4+ MolecularWeight: 298.31324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H16NO4/c1-12(19)14-3-2-6-18(10-14)11-15(20)13-4-5-16-17(9-13)22-8-7-21-16/h2-6,9-10H,7-8,11H2,1H3/q+1