(2S,3S,4S,5R)-6-[4-[2,4-bis(fluoranyl)phenyl]-2-ethanoyl-phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R)-6-[4-[2,4-bis(fluoranyl)phenyl]-2-ethanoyl-phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R)-6-[2-acetyl-4-(2,4-difluorophenyl)phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R)-6-[2-acetyl-4-(2,4-difluorophenyl)phenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R)-6-[2-acetyl-4-(2,4-difluorophenyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R)-6-[2-acetyl-4-(2,4-difluorophenyl)phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid Formula: C20H18F2O8 MolecularWeight: 424.348926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)C2=C(C=C(C=C2)F)F)OC3C(C(C(C(O3)C(=O)O)O)O)O

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)C2=C(C=C(C=C2)F)F)OC3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O

InChI

InChI=1S/C20H18F2O8/c1-8(23)12-6-9(11-4-3-10(21)7-13(11)22)2-5-14(12)29-20-17(26)15(24)16(25)18(30-20)19(27)28/h2-7,15-18,20,24-26H,1H3,(H,27,28)/t15-,16-,17+,18-,20?/m0/s1