[2-phenyl-3-[2-(trifluoromethyl)phenyl]oxiran-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [2-phenyl-3-[2-(trifluoromethyl)phenyl]oxiran-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [2-phenyl-3-[2-(trifluoromethyl)phenyl]oxiran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-phenyl-3-[2-(trifluoromethyl)phenyl]-2-oxiranyl]methyl ester IUPAC Name: [2-phenyl-3-[2-(trifluoromethyl)phenyl]oxiran-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-phenyl-3-[2-(trifluoromethyl)phenyl]oxiran-2-yl]methyl ester Formula: C23H19F3O4S MolecularWeight: 448.45477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2(C(O2)C3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2(C(O2)C3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C23H19F3O4S/c1-16-11-13-18(14-12-16)31(27,28)29-15-22(17-7-3-2-4-8-17)21(30-22)19-9-5-6-10-20(19)23(24,25)26/h2-14,21H,15H2,1H3