1-[1-(1,3-benzodioxol-5-ylmethyl)pyridin-1-ium-3-yl]ethanone

Systemtic Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)pyridin-1-ium-3-yl]ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)pyridin-1-ium-3-yl]ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-3-pyridin-1-iumyl]ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)pyridin-1-ium-3-yl]ethanone Traditional Name: 1-(1-piperonylpyridin-1-ium-3-yl)ethanone Formula: C15H14NO3+ MolecularWeight: 256.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H14NO3/c1-11(17)13-3-2-6-16(9-13)8-12-4-5-14-15(7-12)19-10-18-14/h2-7,9H,8,10H2,1H3/q+1