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

Systemtic Name: 3-[3-[4-[(E)-4,4-bis(fluoranyl)-3-oxidanyl-4-phenyl-but-1-enyl]-2-oxidanylidene-1,3-thiazolidin-3-yl]propyl]benzoic acid Openeye Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-oxo-thiazolidin-3-yl]propyl]benzoic acid CAS Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-3-thiazolidinyl]propyl]benzoic acid IUPAC Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]propyl]benzoic acid Traditional Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-thiazolidin-3-yl]propyl]benzoic acid Formula: C23H23F2NO4S MolecularWeight: 447.494826

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)S1)CCCC2=CC=CC(=C2)C(=O)O)C=CC(C(C3=CC=CC=C3)(F)F)O

Isomeric SMILES

C1C(N(C(=O)S1)CCCC2=CC=CC(=C2)C(=O)O)/C=C/C(C(C3=CC=CC=C3)(F)F)O

InChI

InChI=1S/C23H23F2NO4S/c24-23(25,18-9-2-1-3-10-18)20(27)12-11-19-15-31-22(30)26(19)13-5-7-16-6-4-8-17(14-16)21(28)29/h1-4,6,8-12,14,19-20,27H,5,7,13,15H2,(H,28,29)/b12-11+