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3-benzofurancarboxylic acid, 5-[[(4-chloro-3-nitrophenyl)sulfonyl]amino]-2-(methoxymethyl)-, methyl ester
SpectraBase Compound ID 8c0NX81oR51
InChI InChI=1S/C18H15ClN2O8S/c1-27-9-16-17(18(22)28-2)12-7-10(3-6-15(12)29-16)20-30(25,26)11-4-5-13(19)14(8-11)21(23)24/h3-8,20H,9H2,1-2H3
InChIKey CSQTWOXVQMHCNV-UHFFFAOYSA-N
Mol Weight 454.84 g/mol
Molecular Formula C18H15ClN2O8S
Exact Mass 454.023764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqiQUIA4MoN
Name 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylic acid methyl ester
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Formula C18H15ClN2O8S
InChI InChI=1S/C18H15ClN2O8S/c1-27-9-16-17(18(22)28-2)12-7-10(3-6-15(12)29-16)20-30(25,26)11-4-5-13(19)14(8-11)21(23)24/h3-8,20H,9H2,1-2H3
InChIKey CSQTWOXVQMHCNV-UHFFFAOYSA-N
Molecular Weight 454.837 g/mol
SMILES N(S(c1cc(N(=O)=O)c(cc1)Cl)(=O)=O)c1cc2c(c(COC)oc2cc1)C(=O)OC
SPLASH splash10-01za-8920000000-22c2fe8ce466d25613bf
Synonyms 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-(methoxymethyl)-3-benzofurancarboxylic acid methyl ester Methyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Methyl 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylate Methyl 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate
Wiley ID 1453452