4-[[2-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester

SpectraBase Compound ID	5PzBE289Y6h
InChI	InChI=1S/C25H31N3O4/c1-5-32-24(31)28-16-14-27(15-17-28)23(30)20-8-6-7-9-21(20)26-22(29)18-10-12-19(13-11-18)25(2,3)4/h6-13H,5,14-17H2,1-4H3,(H,26,29)
InChIKey	MEQHUDRSLLZLQD-UHFFFAOYSA-N Google Search
Mol Weight	437.54 g/mol
Molecular Formula	C25H31N3O4
Exact Mass	437.231456 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	YpZJeAAsyC
Name	4-[[2-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	437.231456486 u
Formula	C25H31N3O4
InChI	InChI=1S/C25H31N3O4/c1-5-32-24(31)28-16-14-27(15-17-28)23(30)20-8-6-7-9-21(20)26-22(29)18-10-12-19(13-11-18)25(2,3)4/h6-13H,5,14-17H2,1-4H3,(H,26,29)
InChIKey	MEQHUDRSLLZLQD-UHFFFAOYSA-N
Molecular Weight	437.540 g/mol
SMILES	C(C1=C(NC(C=2C=CC(C(C)(C)C)=CC2)=O)C=CC=C1)(N1CCN(CC1)C(=O)OCC)=O