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2-Benzofuranbutanoic acid, 3-[[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]amino]-.gamma.-oxo-, methyl ester
SpectraBase Compound ID AHFOh5YCcEg
InChI InChI=1S/C25H22N2O7/c1-33-21(30)13-12-18(28)23-22(17-9-4-5-10-19(17)34-23)26-20(29)11-6-14-27-24(31)15-7-2-3-8-16(15)25(27)32/h2-5,7-10H,6,11-14H2,1H3,(H,26,29)
InChIKey HKEBWEDGVIFWSG-UHFFFAOYSA-N
Mol Weight 462.46 g/mol
Molecular Formula C25H22N2O7
Exact Mass 462.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nqQCSnoLad
Name 2-Benzofuranbutanoic acid, 3-[[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]amino]-.gamma.-oxo-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22N2O7
InChI InChI=1S/C25H22N2O7/c1-33-21(30)13-12-18(28)23-22(17-9-4-5-10-19(17)34-23)26-20(29)11-6-14-27-24(31)15-7-2-3-8-16(15)25(27)32/h2-5,7-10H,6,11-14H2,1H3,(H,26,29)
InChIKey HKEBWEDGVIFWSG-UHFFFAOYSA-N
Molecular Weight 462.458 g/mol
SMILES N(c1c(oc2c1cccc2)C(=O)CCC(=O)OC)C(CCCN1C(c2ccccc2C1=O)=O)=O
SPLASH splash10-01ot-2960100000-0b21d8990d414625e4f4
Source of Spectrum IY-1-4598-6
Synonyms 4-[3-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-2-benzofuranyl]-4-oxobutanoic acid methyl ester Methyl 4-[3-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]-1-benzofuran-2-yl]-4-oxobutanoate Methyl 4-[3-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]benzofuran-2-yl]-4-oxo-butanoate Methyl 4-[3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-1-benzofuran-2-yl]-4-oxidanylidene-butanoate
Wiley ID 1653969