ethyl 4,4-bis(fluoranyl)-2-phenylsulfanyl-3-(trifluoromethyl)but-3-enoate

Systemtic Name: ethyl 4,4-bis(fluoranyl)-2-phenylsulfanyl-3-(trifluoromethyl)but-3-enoate Openeye Name: ethyl 4,4-difluoro-2-phenylsulfanyl-3-(trifluoromethyl)but-3-enoate CAS Name: 4,4-difluoro-2-(phenylthio)-3-(trifluoromethyl)-3-butenoic acid ethyl ester IUPAC Name: ethyl 4,4-difluoro-2-phenylsulfanyl-3-(trifluoromethyl)but-3-enoate Traditional Name: 4,4-difluoro-2-(phenylthio)-3-(trifluoromethyl)but-3-enoic acid ethyl ester Formula: C13H11F5O2S MolecularWeight: 326.282256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=C(F)F)C(F)(F)F)SC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C(=C(F)F)C(F)(F)F)SC1=CC=CC=C1

InChI

InChI=1S/C13H11F5O2S/c1-2-20-12(19)10(9(11(14)15)13(16,17)18)21-8-6-4-3-5-7-8/h3-7,10H,2H2,1H3