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N-(BENZYL)-4-[2-[(TERT.-BUTOXYCARBONYL)-AMINO]-ACETYL]-2-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER

Compound with spectra: 2 NMR

N-(BENZYL)-4-[2-[(TERT.-BUTOXYCARBONYL)-AMINO]-ACETYL]-2-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER
SpectraBase Compound ID E8d9pN35RcC
InChI InChI=1S/C25H31N3O5/c1-17-16-28(21(29)15-27-24(31)33-25(2,3)4)22(19-12-8-9-13-20(19)32-17)23(30)26-14-18-10-6-5-7-11-18/h5-13,17,22H,14-16H2,1-4H3,(H,26,30)(H,27,31)/t17-,22+/m0/s1
InChIKey WIIQPBLCGNNGHI-HTAPYJJXSA-N
Mol Weight 453.54 g/mol
Molecular Formula C25H31N3O5
Exact Mass 453.226371 g/mol
Enantiomer InChIKey WIIQPBLCGNNGHI-VGSWGCGISA-N

View Spectrum of N-(BENZYL)-4-[2-[(TERT.-BUTOXYCARBONYL)-AMINO]-ACETYL]-2-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

View Spectrum of N-(BENZYL)-4-[2-[(TERT.-BUTOXYCARBONYL)-AMINO]-ACETYL]-2-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • N-(BENZYL)-4-[2-[(TERT.-BUTOXYCARBONYL)-AMINO]-ACETYL]-2-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MINOR-ROTAMER
MAJOR-ROTAMER-A
2-(Benzo[d][1,3]dioxol-5-yl)-N-(tert-butyl)-2-(3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)acetamide
Ethyl 2-(2-(3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)-2-(3,4,5-trimethoxyphenyl)acetamido)acetate
cyclohexanol, 1-[(E)-(3-(4-morpholinyl)-5-nitro-2(3H)-benzofuranylidene)methyl]-
5-(2,4-dichlorophenyl)-3-hydroxy-4-(3-methoxybenzoyl)-1,5-dihydro-2H-pyrrol-2-one
N-(2,6-Dimethylphenyl)-2-(9-methoxy-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)-2-phenylacetamide
1,2,3,4-tetrahydro-5,8-dimethoxy-2,2-dimethyl-1-(3-phenoxybenzyl)-isoquinolinium iodide
Tri(2-azulenyl)-1-tert-butylazetidin-2-one
1-acetyl-5-(2,5-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole
3-Acetyl-4-(2-imino-1-ethoxycarbonylpropyl)-6-nitrochroman-2-one
(2S)-N2-(1S,3R,9S,12R,15S)-3,12-DIMETHYL-4,10,13-TRIOXO-2-THIA-5,11,14-TRIAZATRICYCLO-[12.2.1.0(5,9)]-HEPTADECAN-15-YLCARBONYL)-PHENYLALANINE-METH
Title Journal or Book Year
Long-Range Diastereoselectivity in an Ugi Reaction: Stereocontrolled and Diversity-Oriented Synthesis of Tetrahydrobenzoxazepines European Journal of Organic Chemistry 2013
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