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(2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methoxyphenyl)-2-propenamide

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(2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methoxyphenyl)-2-propenamide
SpectraBase Compound ID 70rZwn2gg5w
InChI InChI=1S/C21H19N3O2/c1-26-18-6-4-5-15(12-18)11-17(13-22)21(25)23-10-9-16-14-24-20-8-3-2-7-19(16)20/h2-8,11-12,14,24H,9-10H2,1H3,(H,23,25)/b17-11+
InChIKey FIYZDGPQZAYAOZ-GZTJUZNOSA-N
Mol Weight 345.4 g/mol
Molecular Formula C21H19N3O2
Exact Mass 345.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2vfDympL9Fm
Name (2E)-2-Cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methoxyphenyl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.147726862 u
Formula C21H19N3O2
InChI InChI=1S/C21H19N3O2/c1-26-18-6-4-5-15(12-18)11-17(13-22)21(25)23-10-9-16-14-24-20-8-3-2-7-19(16)20/h2-8,11-12,14,24H,9-10H2,1H3,(H,23,25)/b17-11+
InChIKey FIYZDGPQZAYAOZ-GZTJUZNOSA-N
Molecular Weight 345.402 g/mol
SMILES N(C(\C(=C\C1=CC(OC)=CC=C1)C#N)=O)CCC1=CNC2=C1C=CC=C2