3-[3,3-dimethyl-5-(2-methylpropyl)-2H-1-benzofuran-7-yl]-4-(trifluoromethyloxy)benzaldehyde

Systemtic Name: 3-[3,3-dimethyl-5-(2-methylpropyl)-2H-1-benzofuran-7-yl]-4-(trifluoromethyloxy)benzaldehyde Openeye Name: 3-(5-isobutyl-3,3-dimethyl-2H-benzofuran-7-yl)-4-(trifluoromethoxy)benzaldehyde CAS Name: 3-[3,3-dimethyl-5-(2-methylpropyl)-2H-benzofuran-7-yl]-4-(trifluoromethoxy)benzaldehyde IUPAC Name: 3-[3,3-dimethyl-5-(2-methylpropyl)-2H-1-benzofuran-7-yl]-4-(trifluoromethoxy)benzaldehyde Traditional Name: 3-(5-isobutyl-3,3-dimethyl-coumaran-7-yl)-4-(trifluoromethoxy)benzaldehyde Formula: C22H23F3O3 MolecularWeight: 392.41143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=C(C(=C1)C3=C(C=CC(=C3)C=O)OC(F)(F)F)OCC2(C)C

Isomeric SMILES

CC(C)CC1=CC2=C(C(=C1)C3=C(C=CC(=C3)C=O)OC(F)(F)F)OCC2(C)C

InChI

InChI=1S/C22H23F3O3/c1-13(2)7-15-9-17(20-18(10-15)21(3,4)12-27-20)16-8-14(11-26)5-6-19(16)28-22(23,24)25/h5-6,8-11,13H,7,12H2,1-4H3