[(1R)-2,2,2-tris(fluoranyl)-1-phenylmethoxy-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [(1R)-2,2,2-tris(fluoranyl)-1-phenylmethoxy-ethyl] 4-methylbenzenesulfonate Openeye Name: [(1R)-1-benzyloxy-2,2,2-trifluoro-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1R)-2,2,2-trifluoro-1-phenylmethoxyethyl] ester IUPAC Name: [(1R)-2,2,2-trifluoro-1-phenylmethoxyethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R)-1-benzoxy-2,2,2-trifluoro-ethyl] ester Formula: C16H15F3O4S MolecularWeight: 360.34811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C(F)(F)F)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](C(F)(F)F)OCC2=CC=CC=C2

InChI

InChI=1S/C16H15F3O4S/c1-12-7-9-14(10-8-12)24(20,21)23-15(16(17,18)19)22-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3/t15-/m1/s1