(2-chloranyl-5-methyl-phenyl) 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: (2-chloro-5-methyl-phenyl) 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid (2-chloro-5-methyl-phenyl) ester Formula: C15H11ClF2O4S MolecularWeight: 360.760246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F

InChI

InChI=1S/C15H11ClF2O4S/c1-9-2-7-12(16)13(8-9)22-14(19)10-3-5-11(6-4-10)23(20,21)15(17)18/h2-8,15H,1H3