1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone CAS Name: 1-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-(2,3-dimethyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanone Formula: C18H25N2O+ MolecularWeight: 285.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)C[N+]2=CC=CC(=C2C)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)C[N+]2=CC=CC(=C2C)C)C

InChI

InChI=1S/C18H25N2O/c1-6-9-20-14(3)11-17(16(20)5)18(21)12-19-10-7-8-13(2)15(19)4/h7-8,10-11H,6,9,12H2,1-5H3/q+1