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

Systemtic Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(4-ethyl-1-pyridin-1-iumyl)-1-[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C21H22FN2O+ MolecularWeight: 337.410583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H22FN2O/c1-4-17-9-11-23(12-10-17)14-21(25)20-13-15(2)24(16(20)3)19-7-5-18(22)6-8-19/h5-13H,4,14H2,1-3H3/q+1