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

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C22H26N3O2+ MolecularWeight: 364.46074

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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=C(C=C3)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N3O2/c1-16-14-21(17(2)25(16)19-6-8-20(27-5)9-7-19)22(26)15-24-12-10-18(11-13-24)23(3)4/h6-14H,15H2,1-5H3/q+1