(2,5-dimethylphenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (2,5-dimethylphenyl)methyl 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (2,5-dimethylbenzyl) ester Formula: C17H16F2O4S MolecularWeight: 354.368346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F

InChI

InChI=1S/C17H16F2O4S/c1-11-3-4-12(2)14(9-11)10-23-16(20)13-5-7-15(8-6-13)24(21,22)17(18)19/h3-9,17H,10H2,1-2H3