4-chloranyl-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium

Systemtic Name: 4-chloranyl-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Openeye Name: 4-chloro-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium CAS Name: 4-chloro-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium IUPAC Name: 4-chloro-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Traditional Name: 4-chloro-1-ethyl-3-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Formula: C21H18ClF3NO+ MolecularWeight: 392.82193

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC(=C(C(=C1)C2=CC=C(C=C2)OC)Cl)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC[N+]1=CC(=C(C(=C1)C2=CC=C(C=C2)OC)Cl)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18ClF3NO/c1-3-26-12-18(14-7-9-17(27-2)10-8-14)20(22)19(13-26)15-5-4-6-16(11-15)21(23,24)25/h4-13H,3H2,1-2H3/q+1