4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-5-methylsulfonyl-benzoyl chloride Openeye Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-5-methylsulfonyl-benzoyl chloride CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-5-methylsulfonylbenzoyl chloride IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-5-methylsulfonylbenzoyl chloride Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-5-mesyl-2-methyl-benzoyl chloride Formula: C17H11ClF6O3S MolecularWeight: 444.775859

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClF6O3S/c1-8-3-13(14(28(2,26)27)7-12(8)15(18)25)9-4-10(16(19,20)21)6-11(5-9)17(22,23)24/h3-7H,1-2H3