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

Systemtic Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-methylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-methylpyridin-1-ium-1-yl)ethanone CAS Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-(2-methyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-(2-methylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-methylpyridin-1-ium-1-yl)ethanone Formula: C22H25N2O+ MolecularWeight: 333.4467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)C[N+]3=CC=CC=C3C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)C[N+]3=CC=CC=C3C)C)C

InChI

InChI=1S/C22H25N2O/c1-15-9-10-20(12-16(15)2)24-18(4)13-21(19(24)5)22(25)14-23-11-7-6-8-17(23)3/h6-13H,14H2,1-5H3/q+1