4-[3,5-dicyclopropyl-1-(trifluoromethylsulfonylmethyl)pyrazol-4-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[3,5-dicyclopropyl-1-(trifluoromethylsulfonylmethyl)pyrazol-4-yl]oxybenzenecarbonitrile Openeye Name: 4-[3,5-dicyclopropyl-1-(trifluoromethylsulfonylmethyl)pyrazol-4-yl]oxybenzonitrile CAS Name: 4-[[3,5-dicyclopropyl-1-(trifluoromethylsulfonylmethyl)-4-pyrazolyl]oxy]benzonitrile IUPAC Name: 4-[3,5-dicyclopropyl-1-(trifluoromethylsulfonylmethyl)pyrazol-4-yl]oxybenzonitrile Traditional Name: 4-[3,5-dicyclopropyl-1-(triflylmethyl)pyrazol-4-yl]oxybenzonitrile Formula: C18H16F3N3O3S MolecularWeight: 411.39815

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CS(=O)(=O)C(F)(F)F)C3CC3)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC1C2=C(C(=NN2CS(=O)(=O)C(F)(F)F)C3CC3)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H16F3N3O3S/c19-18(20,21)28(25,26)10-24-16(13-5-6-13)17(15(23-24)12-3-4-12)27-14-7-1-11(9-22)2-8-14/h1-2,7-8,12-13H,3-6,10H2