2-[(E)-[phenyl-[2-(N-phenylanilino)phenyl]methylene]amino]oxyperacetic acid tert-butyl ester

SpectraBase Compound ID	8dug2G1zqnU
InChI	InChI=1S/C31H30N2O4/c1-31(2,3)37-36-29(34)23-35-32-30(24-15-7-4-8-16-24)27-21-13-14-22-28(27)33(25-17-9-5-10-18-25)26-19-11-6-12-20-26/h4-22H,23H2,1-3H3/b32-30+
InChIKey	QLSJZLDFAFSZKO-NHQGMKOOSA-N Google Search
Mol Weight	494.59 g/mol
Molecular Formula	C31H30N2O4
Exact Mass	494.220557 g/mol

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SpectraBase Spectrum ID	A7WjCzBwDTg
Name	2-[(E)-[Phenyl-[2-(N-phenylanilino)phenyl]methylene]amino]oxyperacetic acid tert-butyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	494.220557450 u
Formula	C31H30N2O4
InChI	InChI=1S/C31H30N2O4/c1-31(2,3)37-36-29(34)23-35-32-30(24-15-7-4-8-16-24)27-21-13-14-22-28(27)33(25-17-9-5-10-18-25)26-19-11-6-12-20-26/h4-22H,23H2,1-3H3/b32-30+
InChIKey	QLSJZLDFAFSZKO-NHQGMKOOSA-N
Molecular Weight	494.591 g/mol
SMILES	C=1(C(\C(=N\OCC(OOC(C)(C)C)=O)C=2C=CC=CC2)=CC=CC1)N(C=1C=CC=CC1)C=1C=CC=CC1