1-[3-[(3-ethanoylpyridin-1-ium-1-yl)methyl]-4-ethoxy-phenyl]ethanone

Systemtic Name: 1-[3-[(3-ethanoylpyridin-1-ium-1-yl)methyl]-4-ethoxy-phenyl]ethanone Openeye Name: 1-[3-[(3-acetylpyridin-1-ium-1-yl)methyl]-4-ethoxy-phenyl]ethanone CAS Name: 1-[3-[(3-acetyl-1-pyridin-1-iumyl)methyl]-4-ethoxyphenyl]ethanone IUPAC Name: 1-[3-[(3-acetylpyridin-1-ium-1-yl)methyl]-4-ethoxyphenyl]ethanone Traditional Name: 1-[3-[(3-acetylpyridin-1-ium-1-yl)methyl]-4-ethoxy-phenyl]ethanone Formula: C18H20NO3+ MolecularWeight: 298.3563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)C[N+]2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)C[N+]2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C18H20NO3/c1-4-22-18-8-7-15(13(2)20)10-17(18)12-19-9-5-6-16(11-19)14(3)21/h5-11H,4,12H2,1-3H3/q+1