[2-methyl-4-(trifluoromethyl)phenyl] 4-chloranylbenzenesulfonate

Systemtic Name: [2-methyl-4-(trifluoromethyl)phenyl] 4-chloranylbenzenesulfonate Openeye Name: [2-methyl-4-(trifluoromethyl)phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [2-methyl-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-methyl-4-(trifluoromethyl)phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [2-methyl-4-(trifluoromethyl)phenyl] ester Formula: C14H10ClF3O3S MolecularWeight: 350.74061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClF3O3S/c1-9-8-10(14(16,17)18)2-7-13(9)21-22(19,20)12-5-3-11(15)4-6-12/h2-8H,1H3