3-[3-tert-butyl-5-methyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1-benzothiophene

Systemtic Name: 3-[3-tert-butyl-5-methyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1-benzothiophene Openeye Name: 3-[3-tert-butyl-5-methyl-2-(2,2,2-trifluoroethoxy)phenyl]benzothiophene CAS Name: 3-[3-tert-butyl-5-methyl-2-(2,2,2-trifluoroethoxy)phenyl]-1-benzothiophene IUPAC Name: 3-[3-tert-butyl-5-methyl-2-(2,2,2-trifluoroethoxy)phenyl]-1-benzothiophene Traditional Name: 3-[3-tert-butyl-5-methyl-2-(2,2,2-trifluoroethoxy)phenyl]benzothiophene Formula: C21H21F3OS MolecularWeight: 378.45105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSC3=CC=CC=C32)OCC(F)(F)F)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSC3=CC=CC=C32)OCC(F)(F)F)C(C)(C)C

InChI

InChI=1S/C21H21F3OS/c1-13-9-15(16-11-26-18-8-6-5-7-14(16)18)19(25-12-21(22,23)24)17(10-13)20(2,3)4/h5-11H,12H2,1-4H3