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

Systemtic Name: 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]-2-(3-ethanoylpyridin-1-ium-1-yl)ethanone Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(2-chlorobenzyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C22H22ClN2O2+ MolecularWeight: 381.87528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2Cl)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2Cl)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H22ClN2O2/c1-15-11-20(16(2)25(15)13-19-7-4-5-9-21(19)23)22(27)14-24-10-6-8-18(12-24)17(3)26/h4-12H,13-14H2,1-3H3/q+1