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

Systemtic Name: 2-(3-ethanoylpyridin-1-ium-1-yl)-1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C24H27N2O3+ MolecularWeight: 391.48278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=C(C=C2)OC)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=C(C=C2)OC)C)C(=O)C[N+]3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C24H27N2O3/c1-17-14-23(24(28)16-25-12-5-6-21(15-25)19(3)27)18(2)26(17)13-11-20-7-9-22(29-4)10-8-20/h5-10,12,14-15H,11,13,16H2,1-4H3/q+1