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(S)-3-(2-Carbamoyl-2-[(5-oxo-5-ethoxy-4-ethoxycarbonyl-penta-1,3-dienyl)-amino]-ethyl)-1H-indole

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(S)-3-(2-Carbamoyl-2-[(5-oxo-5-ethoxy-4-ethoxycarbonyl-penta-1,3-dienyl)-amino]-ethyl)-1H-indole
SpectraBase Compound ID 5MsxgX3N7K5
InChI InChI=1S/C21H25N3O5/c1-3-28-20(26)16(21(27)29-4-2)9-7-11-23-18(19(22)25)12-14-13-24-17-10-6-5-8-15(14)17/h5-11,13,18,23-24H,3-4,12H2,1-2H3,(H2,22,25)/b11-7+
InChIKey KMTXADJLNBAGEK-YRNVUSSQSA-N
Mol Weight 399.45 g/mol
Molecular Formula C21H25N3O5
Exact Mass 399.179421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kt5op07z9D7
Name (S)-3-(2-Carbamoyl-2-[(5-oxo-5-ethoxy-4-ethoxycarbonyl-penta-1,3-dienyl)-amino]-ethyl)-1H-indole
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H25N3O5
InChI InChI=1S/C21H25N3O5/c1-3-28-20(26)16(21(27)29-4-2)9-7-11-23-18(19(22)25)12-14-13-24-17-10-6-5-8-15(14)17/h5-11,13,18,23-24H,3-4,12H2,1-2H3,(H2,22,25)/b11-7+
InChIKey KMTXADJLNBAGEK-YRNVUSSQSA-N
Instrument Name SF = 500 MHz
Literature Reference L.E. Overman, A.J. Robichaud, J. Am. Chem. Soc. 111, 300 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3