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4-Tert-butyl-N-[(Z)-1-(2-furanyl)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]benzamide
SpectraBase Compound ID 8RSNlxlJjQM
InChI InChI=1S/C29H31N3O3/c1-19-23(24-9-5-6-10-25(24)31-19)15-16-30-28(34)26(18-22-8-7-17-35-22)32-27(33)20-11-13-21(14-12-20)29(2,3)4/h5-14,17-18,31H,15-16H2,1-4H3,(H,30,34)(H,32,33)/b26-18-
InChIKey VIFLWMXTJSJZPC-ITYLOYPMSA-N
Mol Weight 469.59 g/mol
Molecular Formula C29H31N3O3
Exact Mass 469.236542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AiCnsn6sHNM
Name 4-Tert-butyl-N-[(Z)-1-(2-furanyl)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.236541867 u
Formula C29H31N3O3
InChI InChI=1S/C29H31N3O3/c1-19-23(24-9-5-6-10-25(24)31-19)15-16-30-28(34)26(18-22-8-7-17-35-22)32-27(33)20-11-13-21(14-12-20)29(2,3)4/h5-14,17-18,31H,15-16H2,1-4H3,(H,30,34)(H,32,33)/b26-18-
InChIKey VIFLWMXTJSJZPC-ITYLOYPMSA-N
Molecular Weight 469.585 g/mol
SMILES C=1C=CC2=C(NC(=C2CCNC(\C(=C\C=2OC=CC2)NC(C=2C=CC(C(C)(C)C)=CC2)=O)=O)C)C1