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N-[(1R,2R)-2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]cyclohexyl]-3,5-bis(chloranyl)-2-oxidanyl-benzenesulfonamide

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N-[(1R,2R)-2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]cyclohexyl]-3,5-bis(chloranyl)-2-oxidanyl-benzenesulfonamide
SpectraBase Compound ID CRrFL5Ucdw3
InChI InChI=1S/C18H18Cl4N2O6S2/c19-9-5-11(21)17(25)15(7-9)31(27,28)23-13-3-1-2-4-14(13)24-32(29,30)16-8-10(20)6-12(22)18(16)26/h5-8,13-14,23-26H,1-4H2/t13-,14-/m1/s1
InChIKey HJPDAEKXWUUQGK-ZIAGYGMSSA-N
Mol Weight 564.3 g/mol
Molecular Formula C18H18Cl4N2O6S2
Exact Mass 561.936039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1xbtA7Fs4w
Name N-[(1R,2R)-2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]cyclohexyl]-3,5-bis(chloranyl)-2-oxidanyl-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Cl4N2O6S2
InChI InChI=1S/C18H18Cl4N2O6S2/c19-9-5-11(21)17(25)15(7-9)31(27,28)23-13-3-1-2-4-14(13)24-32(29,30)16-8-10(20)6-12(22)18(16)26/h5-8,13-14,23-26H,1-4H2/t13-,14-/m1/s1
InChIKey HJPDAEKXWUUQGK-ZIAGYGMSSA-N
Molecular Weight 564.282 g/mol
SMILES Oc1c(S(N[C@]2([C@](NS(c3c(c(cc(c3)Cl)Cl)O)(=O)=O)(CCCC2)[H])[H])(=O)=O)cc(cc1Cl)Cl
SPLASH splash10-0002-9001010000-715437ceab57ddd3a4de
Source of Spectrum F-53-4153-1
Synonyms 3,5-Dichloro-N-[(1R,2R)-2-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]cyclohexyl]-2-hydroxybenzenesulfonamide
Wiley ID 801283