5,7-bis(2-methylbutan-2-yl)-3-oxidanyl-3-(trifluoromethyl)-1-benzofuran-2-one

Systemtic Name: 5,7-bis(2-methylbutan-2-yl)-3-oxidanyl-3-(trifluoromethyl)-1-benzofuran-2-one Openeye Name: 5,7-bis(1,1-dimethylpropyl)-3-hydroxy-3-(trifluoromethyl)benzofuran-2-one CAS Name: 3-hydroxy-5,7-bis(2-methylbutan-2-yl)-3-(trifluoromethyl)-2-benzofuranone IUPAC Name: 3-hydroxy-5,7-bis(2-methylbutan-2-yl)-3-(trifluoromethyl)-1-benzofuran-2-one Traditional Name: 5,7-ditert-amyl-3-hydroxy-3-(trifluoromethyl)coumaran-2-one Formula: C19H25F3O3 MolecularWeight: 358.39521

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C2C(=C1)C(C(=O)O2)(C(F)(F)F)O)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C2C(=C1)C(C(=O)O2)(C(F)(F)F)O)C(C)(C)CC

InChI

InChI=1S/C19H25F3O3/c1-7-16(3,4)11-9-12(17(5,6)8-2)14-13(10-11)18(24,15(23)25-14)19(20,21)22/h9-10,24H,7-8H2,1-6H3