1H-Isoindole-1,3(2H)-dione, 2-[2-(benzoyloxy)-1-(4-methoxyphenyl)-4-oxo-3-azetidinyl]-, trans-

SpectraBase Compound ID	9mZwf4d49iR
InChI	InChI=1S/C25H18N2O6/c1-32-17-13-11-16(12-14-17)26-23(30)20(24(26)33-25(31)15-7-3-2-4-8-15)27-21(28)18-9-5-6-10-19(18)22(27)29/h2-14,20,24H,1H3/t20-,24+/m0/s1
InChIKey	BREHZFMFABTZTG-GBXCKJPGSA-N Google Search
Mol Weight	442.43 g/mol
Molecular Formula	C25H18N2O6
Exact Mass	442.116486 g/mol

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SpectraBase Spectrum ID	6GLESGpj4sP
Name	1H-Isoindole-1,3(2H)-dione, 2-[2-(benzoyloxy)-1-(4-methoxyphenyl)-4-oxo-3-azetidinyl]-, trans-
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	442.116486302 u
Formula	C25H18N2O6
InChI	InChI=1S/C25H18N2O6/c1-32-17-13-11-16(12-14-17)26-23(30)20(24(26)33-25(31)15-7-3-2-4-8-15)27-21(28)18-9-5-6-10-19(18)22(27)29/h2-14,20,24H,1H3/t20-,24+/m0/s1
InChIKey	BREHZFMFABTZTG-GBXCKJPGSA-N
Molecular Weight	442.427 g/mol
SMILES	[C@@]1(N2C(C=3C=CC=CC3C2=O)=O)(C(=O)N([C@@]1(OC(=O)C1=CC=CC=C1)[H])C=1C=CC(=CC1)OC)[H]