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5-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester
SpectraBase Compound ID HHmuxEnhQTO
InChI InChI=1S/C21H24ClNO6S/c1-6-27-20(25)16-13(5)18(21(26)28-7-2)30-19(16)23-15(24)10-29-14-8-11(3)17(22)12(4)9-14/h8-9H,6-7,10H2,1-5H3,(H,23,24)
InChIKey XICDOXYVMHKAMP-UHFFFAOYSA-N
Mol Weight 453.94 g/mol
Molecular Formula C21H24ClNO6S
Exact Mass 453.101286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4W56l6i6GM
Name 5-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester
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Formula C21H24ClNO6S
InChI InChI=1S/C21H24ClNO6S/c1-6-27-20(25)16-13(5)18(21(26)28-7-2)30-19(16)23-15(24)10-29-14-8-11(3)17(22)12(4)9-14/h8-9H,6-7,10H2,1-5H3,(H,23,24)
InChIKey XICDOXYVMHKAMP-UHFFFAOYSA-N
Molecular Weight 453.937 g/mol
SMILES N(c1c(c(C)c(s1)C(=O)OCC)C(=O)OCC)C(=O)COc1cc(C)c(c(c1)C)Cl
SPLASH splash10-00di-2980200000-254d90d850a3d731b201
Synonyms Diethyl 5-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Diethyl 5-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Diethyl 5-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
Wiley ID 1460717