(4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C21H24F2O4S MolecularWeight: 410.474666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F)C)C(C)(C)C

InChI

InChI=1S/C21H24F2O4S/c1-13-10-16(21(3,4)5)11-14(2)18(13)12-27-19(24)15-6-8-17(9-7-15)28(25,26)20(22)23/h6-11,20H,12H2,1-5H3