fluoranyl 6-ethanoyl-5-methoxy-3-[1-(4-methylsulfinylphenyl)inden-1-yl]oxy-4,6-bis(oxidanyl)oxane-2-carboxylate

Systemtic Name: fluoranyl 6-ethanoyl-5-methoxy-3-[1-(4-methylsulfinylphenyl)inden-1-yl]oxy-4,6-bis(oxidanyl)oxane-2-carboxylate Openeye Name: fluoro 6-acetyl-4,6-dihydroxy-5-methoxy-3-[1-(4-methylsulfinylphenyl)inden-1-yl]oxy-tetrahydropyran-2-carboxylate CAS Name: 6-acetyl-4,6-dihydroxy-5-methoxy-3-[[1-(4-methylsulfinylphenyl)-1-indenyl]oxy]-2-oxanecarboxylic acid fluoro ester IUPAC Name: fluoro 6-acetyl-4,6-dihydroxy-5-methoxy-3-[1-(4-methylsulfinylphenyl)inden-1-yl]oxyoxane-2-carboxylate Traditional Name: 6-acetyl-4,6-dihydroxy-5-methoxy-3-[1-(4-methylsulfinylphenyl)inden-1-yl]oxy-tetrahydropyran-2-carboxylic acid fluoro ester Formula: C25H25FO9S MolecularWeight: 520.524003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(C(C(C(O1)C(=O)OF)OC2(C=CC3=CC=CC=C32)C4=CC=C(C=C4)S(=O)C)O)OC)O

Isomeric SMILES

CC(=O)C1(C(C(C(C(O1)C(=O)OF)OC2(C=CC3=CC=CC=C32)C4=CC=C(C=C4)S(=O)C)O)OC)O

InChI

InChI=1S/C25H25FO9S/c1-14(27)25(30)22(32-2)19(28)20(21(34-25)23(29)35-26)33-24(13-12-15-6-4-5-7-18(15)24)16-8-10-17(11-9-16)36(3)31/h4-13,19-22,28,30H,1-3H3