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

Systemtic Name: 1-[1-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C23H25N2O2+ MolecularWeight: 361.4568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C)C)C

InChI

InChI=1S/C23H25N2O2/c1-15-8-9-21(11-16(15)2)25-17(3)12-22(18(25)4)23(27)14-24-10-6-7-20(13-24)19(5)26/h6-13H,14H2,1-5H3/q+1