1,2-dimethyl-3,5-diphenyl-4-[[3-(trifluoromethyl)phenyl]methoxy]pyrazol-2-ium

Systemtic Name: 1,2-dimethyl-3,5-diphenyl-4-[[3-(trifluoromethyl)phenyl]methoxy]pyrazol-2-ium Openeye Name: 1,2-dimethyl-3,5-diphenyl-4-[[3-(trifluoromethyl)phenyl]methoxy]pyrazol-2-ium CAS Name: 1,2-dimethyl-3,5-diphenyl-4-[[3-(trifluoromethyl)phenyl]methoxy]pyrazol-2-ium IUPAC Name: 1,2-dimethyl-3,5-diphenyl-4-[[3-(trifluoromethyl)phenyl]methoxy]pyrazol-2-ium Traditional Name: 1,2-dimethyl-3,5-diphenyl-4-[3-(trifluoromethyl)benzyl]oxy-pyrazol-2-ium Formula: C25H22F3N2O+ MolecularWeight: 423.45019

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=[N+]1C)C2=CC=CC=C2)OCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C(=[N+]1C)C2=CC=CC=C2)OCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C25H22F3N2O/c1-29-22(19-11-5-3-6-12-19)24(23(30(29)2)20-13-7-4-8-14-20)31-17-18-10-9-15-21(16-18)25(26,27)28/h3-16H,17H2,1-2H3/q+1