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

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)C[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)C[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C16H22N3O/c1-12-10-15(13(2)18(12)5)16(20)11-19-8-6-14(7-9-19)17(3)4/h6-10H,11H2,1-5H3/q+1