phenyl 2-[[(4-methylphenyl)sulfonyldiazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate

Systemtic Name: phenyl 2-[[(4-methylphenyl)sulfonyldiazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate Openeye Name: phenyl 2-(p-tolylsulfonylazomethyl)-4-(trifluoromethyl)benzenesulfonate CAS Name: 2-[(4-methylphenyl)sulfonylazomethyl]-4-(trifluoromethyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-[[(4-methylphenyl)sulfonyldiazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate Traditional Name: 2-(tosylazomethyl)-4-(trifluoromethyl)benzenesulfonic acid phenyl ester Formula: C21H17F3N2O5S2 MolecularWeight: 498.49529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=NCC2=C(C=CC(=C2)C(F)(F)F)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=NCC2=C(C=CC(=C2)C(F)(F)F)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H17F3N2O5S2/c1-15-7-10-19(11-8-15)32(27,28)26-25-14-16-13-17(21(22,23)24)9-12-20(16)33(29,30)31-18-5-3-2-4-6-18/h2-13H,14H2,1H3