trifluoromethylsulfanyl 2-methyl-3-phenyl-propanoate

Systemtic Name: trifluoromethylsulfanyl 2-methyl-3-phenyl-propanoate Openeye Name: trifluoromethylsulfanyl 2-methyl-3-phenyl-propanoate CAS Name: 2-methyl-3-phenylpropanoic acid (trifluoromethylthio) ester IUPAC Name: trifluoromethylsulfanyl 2-methyl-3-phenylpropanoate Traditional Name: 2-methyl-3-phenyl-propionic acid (trifluoromethylthio) ester Formula: C11H11F3O2S MolecularWeight: 264.26405

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C(=O)OSC(F)(F)F

Isomeric SMILES

CC(CC1=CC=CC=C1)C(=O)OSC(F)(F)F

InChI

InChI=1S/C11H11F3O2S/c1-8(7-9-5-3-2-4-6-9)10(15)16-17-11(12,13)14/h2-6,8H,7H2,1H3