N-[4-tert-butyl-1-[(2,6-dimethylanilino)-oxomethyl]cyclohexyl]-2-hydroxy-N-(phenylmethyl)benzamide

SpectraBase Compound ID	GylGB6Qzt8F
InChI	InChI=1S/C33H40N2O3/c1-23-12-11-13-24(2)29(23)34-31(38)33(20-18-26(19-21-33)32(3,4)5)35(22-25-14-7-6-8-15-25)30(37)27-16-9-10-17-28(27)36/h6-17,26,36H,18-22H2,1-5H3,(H,34,38)
InChIKey	KTWOCWOAUWRLFB-UHFFFAOYSA-N Google Search
Mol Weight	512.7 g/mol
Molecular Formula	C33H40N2O3
Exact Mass	512.303893 g/mol

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SpectraBase Spectrum ID	BfmjYHZJevE
Name	N-[4-Tert-butyl-1-[(2,6-dimethylanilino)-oxomethyl]cyclohexyl]-2-hydroxy-N-(phenylmethyl)benzamide
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	512.303893153 u
Formula	C33H40N2O3
InChI	InChI=1S/C33H40N2O3/c1-23-12-11-13-24(2)29(23)34-31(38)33(20-18-26(19-21-33)32(3,4)5)35(22-25-14-7-6-8-15-25)30(37)27-16-9-10-17-28(27)36/h6-17,26,36H,18-22H2,1-5H3,(H,34,38)
InChIKey	KTWOCWOAUWRLFB-UHFFFAOYSA-N
Molecular Weight	512.694 g/mol
SMILES	C=1C=CC(CN(C(C=2C(O)=CC=CC2)=O)C2(C(NC3=C(C=CC=C3C)C)=O)CCC(C(C)(C)C)CC2)=CC1