Benzoic acid, 4-[[5-[[4-(1,1-dimethylethyl)cyclohexyl]oxy]-1,5-dioxopentyl]amino]-, ethyl ester

SpectraBase Compound ID	4rFOx82OA7s
InChI	InChI=1S/C24H35NO5/c1-5-29-23(28)17-9-13-19(14-10-17)25-21(26)7-6-8-22(27)30-20-15-11-18(12-16-20)24(2,3)4/h9-10,13-14,18,20H,5-8,11-12,15-16H2,1-4H3,(H,25,26)
InChIKey	KZYAJFRVVJGADF-UHFFFAOYSA-N Google Search
Mol Weight	417.5 g/mol
Molecular Formula	C24H35NO5
Exact Mass	417.251523 g/mol

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SpectraBase Spectrum ID	7fXdvi0KTdi
Name	Benzoic acid, 4-[[5-[[4-(1,1-dimethylethyl)cyclohexyl]oxy]-1,5-dioxopentyl]amino]-, ethyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	417.251523226 u
Formula	C24H35NO5
InChI	InChI=1S/C24H35NO5/c1-5-29-23(28)17-9-13-19(14-10-17)25-21(26)7-6-8-22(27)30-20-15-11-18(12-16-20)24(2,3)4/h9-10,13-14,18,20H,5-8,11-12,15-16H2,1-4H3,(H,25,26)
InChIKey	KZYAJFRVVJGADF-UHFFFAOYSA-N
Molecular Weight	417.546 g/mol
SMILES	C(CC(=O)NC=1C=CC(=CC1)C(OCC)=O)CC(OC1CCC(CC1)C(C)(C)C)=O