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

Systemtic Name: 1-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-propylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-propylpyridin-1-ium-1-yl)ethanone CAS Name: 1-[1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-propyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-(4-propylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-propylpyridin-1-ium-1-yl)ethanone Formula: C22H24FN2O+ MolecularWeight: 351.437163

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)C3=CC=CC=C3F)C

Isomeric SMILES

CCCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)C3=CC=CC=C3F)C

InChI

InChI=1S/C22H24FN2O/c1-4-7-18-10-12-24(13-11-18)15-22(26)19-14-16(2)25(17(19)3)21-9-6-5-8-20(21)23/h5-6,8-14H,4,7,15H2,1-3H3/q+1