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

Systemtic Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(4-ethyl-1-pyridin-1-iumyl)-1-[1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(4-ethylpyridin-1-ium-1-yl)-1-[1-(2-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=CC=C3F)C

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)C3=CC=CC=C3F)C

InChI

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