[(Z)-3,4,4-tris(fluoranyl)-1-oxidanyl-1-thiophen-2-yl-but-2-en-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-3,4,4-tris(fluoranyl)-1-oxidanyl-1-thiophen-2-yl-but-2-en-2-yl] 4-methylbenzenesulfonate Openeye Name: [(Z)-2,3,3-trifluoro-1-[hydroxy(2-thienyl)methyl]prop-1-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-3,4,4-trifluoro-1-hydroxy-1-thiophen-2-ylbut-2-en-2-yl] ester IUPAC Name: [(Z)-3,4,4-trifluoro-1-hydroxy-1-thiophen-2-ylbut-2-en-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-2,3,3-trifluoro-1-[hydroxy(2-thienyl)methyl]prop-1-enyl] ester Formula: C15H13F3O4S2 MolecularWeight: 378.38653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(=C(C(F)F)F)C(C2=CC=CS2)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/C(=C(/C(F)F)\F)/C(C2=CC=CS2)O

InChI

InChI=1S/C15H13F3O4S2/c1-9-4-6-10(7-5-9)24(20,21)22-14(12(16)15(17)18)13(19)11-3-2-8-23-11/h2-8,13,15,19H,1H3/b14-12-