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2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(3,4,5-trimethoxybenzyl)acetamide

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2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(3,4,5-trimethoxybenzyl)acetamide
SpectraBase Compound ID 4gApJ25nIuo
InChI InChI=1S/C29H29ClN2O6/c1-17-22(15-27(33)31-16-18-12-25(36-3)28(38-5)26(13-18)37-4)23-14-21(35-2)10-11-24(23)32(17)29(34)19-6-8-20(30)9-7-19/h6-14H,15-16H2,1-5H3,(H,31,33)
InChIKey FWNJKZRBZKBXPI-UHFFFAOYSA-N
Mol Weight 537.01 g/mol
Molecular Formula C29H29ClN2O6
Exact Mass 536.171414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2w9EyqWcz4F
Name 2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(3,4,5-trimethoxybenzyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 536.171414356 u
Formula C29H29ClN2O6
InChI InChI=1S/C29H29ClN2O6/c1-17-22(15-27(33)31-16-18-12-25(36-3)28(38-5)26(13-18)37-4)23-14-21(35-2)10-11-24(23)32(17)29(34)19-6-8-20(30)9-7-19/h6-14H,15-16H2,1-5H3,(H,31,33)
InChIKey FWNJKZRBZKBXPI-UHFFFAOYSA-N
Molecular Weight 537.012 g/mol
SMILES COC=1C=CC=2N(C(=C(CC(NCC=3C=C(OC)C(=C(C3)OC)OC)=O)C2C1)C)C(C1=CC=C(C=C1)Cl)=O