3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-4-(phenylsulfonylmethyl)-2-(trifluoromethyl)furan

Systemtic Name: 3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-4-(phenylsulfonylmethyl)-2-(trifluoromethyl)furan Openeye Name: 4-(benzenesulfonylmethyl)-3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-2-(trifluoromethyl)furan CAS Name: 4-(benzenesulfonylmethyl)-3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-2-(trifluoromethyl)furan IUPAC Name: 4-(benzenesulfonylmethyl)-3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-2-(trifluoromethyl)furan Traditional Name: 4-(besylmethyl)-3-(3,3-dimethylbut-1-ynyl)-2-ethoxy-5,5-dimethyl-2-(trifluoromethyl)furan Formula: C22H27F3O4S MolecularWeight: 444.50759

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C(=C(C(O1)(C)C)CS(=O)(=O)C2=CC=CC=C2)C#CC(C)(C)C)C(F)(F)F

Isomeric SMILES

CCOC1(C(=C(C(O1)(C)C)CS(=O)(=O)C2=CC=CC=C2)C#CC(C)(C)C)C(F)(F)F

InChI

InChI=1S/C22H27F3O4S/c1-7-28-21(22(23,24)25)17(13-14-19(2,3)4)18(20(5,6)29-21)15-30(26,27)16-11-9-8-10-12-16/h8-12H,7,15H2,1-6H3