3-methyl-4-(trifluoromethylsulfanyl)benzenesulfinic acid

Systemtic Name: 3-methyl-4-(trifluoromethylsulfanyl)benzenesulfinic acid Openeye Name: 3-methyl-4-(trifluoromethylsulfanyl)benzenesulfinic acid CAS Name: 3-methyl-4-(trifluoromethylthio)benzenesulfinic acid IUPAC Name: 3-methyl-4-(trifluoromethylsulfanyl)benzenesulfinic acid Traditional Name: 3-methyl-4-(trifluoromethylthio)benzenesulfinic acid Formula: C8H7F3O2S2 MolecularWeight: 256.26519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)O)SC(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)O)SC(F)(F)F

InChI

InChI=1S/C8H7F3O2S2/c1-5-4-6(15(12)13)2-3-7(5)14-8(9,10)11/h2-4H,1H3,(H,12,13)