2-(3-ethanoylpyridin-1-ium-1-yl)-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(3-ethanoylpyridin-1-ium-1-yl)-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H23N2O3/c1-15-12-21(16(2)24(15)19-7-9-20(27-4)10-8-19)22(26)14-23-11-5-6-18(13-23)17(3)25/h5-13H,14H2,1-4H3/q+1