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1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-dichloro-4-methoxyphenyl)sulfonyl]piperazine
SpectraBase Compound ID LLXa99fzaUd
InChI InChI=1S/C19H20Cl2N2O5S/c1-26-17-9-15(21)19(10-14(17)20)29(24,25)23-6-4-22(5-7-23)11-13-2-3-16-18(8-13)28-12-27-16/h2-3,8-10H,4-7,11-12H2,1H3
InChIKey GRDZUQVGPJVUJR-UHFFFAOYSA-N
Mol Weight 459.34 g/mol
Molecular Formula C19H20Cl2N2O5S
Exact Mass 458.046998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXcXTKbE5sK
Name 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-dichloro-4-methoxyphenyl)sulfonyl]piperazine
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Formula C19H20Cl2N2O5S
InChI InChI=1S/C19H20Cl2N2O5S/c1-26-17-9-15(21)19(10-14(17)20)29(24,25)23-6-4-22(5-7-23)11-13-2-3-16-18(8-13)28-12-27-16/h2-3,8-10H,4-7,11-12H2,1H3
InChIKey GRDZUQVGPJVUJR-UHFFFAOYSA-N
Molecular Weight 459.344 g/mol
SMILES COc1cc(c(S(N2CCN(CC2)Cc2cc3OCOc3cc2)(=O)=O)cc1Cl)Cl
SPLASH splash10-000i-6920000000-511f43247b68aced7973
Synonyms 1-(1,3-benzodioxol-5-ylmethyl)-4-[2,5-bis(chloranyl)-4-methoxy-phenyl]sulfonyl-piperazine 1-(2,5-dichloro-4-methoxy-phenyl)sulfonyl-4-piperonyl-piperazine 4-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}-2,5-dichlorophenyl methyl ether 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,5-dichloro-4-methoxyphenyl)sulfonylpiperazine
Wiley ID 1445235