[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] 4-chloranylbenzenesulfonate

Systemtic Name: [(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] 4-chloranylbenzenesulfonate Openeye Name: [(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] ester IUPAC Name: [(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl] ester Formula: C16H14ClF3O4S MolecularWeight: 394.79317

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC[C@@H](C1=CC=C(C=C1)C(F)(F)F)OS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H14ClF3O4S/c1-23-10-15(11-2-4-12(5-3-11)16(18,19)20)24-25(21,22)14-8-6-13(17)7-9-14/h2-9,15H,10H2,1H3/t15-/m0/s1