5-[3-[4-[(E)-4,4-bis(fluoranyl)-3-oxidanyl-4-phenyl-but-1-enyl]-2-oxidanylidene-1,3-thiazolidin-3-yl]propyl]furan-2-carboxylic acid

Systemtic Name: 5-[3-[4-[(E)-4,4-bis(fluoranyl)-3-oxidanyl-4-phenyl-but-1-enyl]-2-oxidanylidene-1,3-thiazolidin-3-yl]propyl]furan-2-carboxylic acid Openeye Name: 5-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-oxo-thiazolidin-3-yl]propyl]furan-2-carboxylic acid CAS Name: 5-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-3-thiazolidinyl]propyl]-2-furancarboxylic acid IUPAC Name: 5-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]propyl]furan-2-carboxylic acid Traditional Name: 5-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-thiazolidin-3-yl]propyl]-2-furoic acid Formula: C21H21F2NO5S MolecularWeight: 437.456946

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)S1)CCCC2=CC=C(O2)C(=O)O)C=CC(C(C3=CC=CC=C3)(F)F)O

Isomeric SMILES

C1C(N(C(=O)S1)CCCC2=CC=C(O2)C(=O)O)/C=C/C(C(C3=CC=CC=C3)(F)F)O

InChI

InChI=1S/C21H21F2NO5S/c22-21(23,14-5-2-1-3-6-14)18(25)11-8-15-13-30-20(28)24(15)12-4-7-16-9-10-17(29-16)19(26)27/h1-3,5-6,8-11,15,18,25H,4,7,12-13H2,(H,26,27)/b11-8+