(2E)-2-cyano-N-cyclopropyl-3-{1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-2-propenamide

SpectraBase Compound ID	Kv8PwZQ1ONy
InChI	InChI=1S/C25H25N3O2/c1-17-7-10-22(13-18(17)2)30-12-11-28-16-20(23-5-3-4-6-24(23)28)14-19(15-26)25(29)27-21-8-9-21/h3-7,10,13-14,16,21H,8-9,11-12H2,1-2H3,(H,27,29)/b19-14+
InChIKey	DJAQGTZNCBDMNL-XMHGGMMESA-N Google Search
Mol Weight	399.49 g/mol
Molecular Formula	C25H25N3O2
Exact Mass	399.194677 g/mol

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SpectraBase Spectrum ID	HctNR8ecys2
Name	(2E)-2-cyano-N-cyclopropyl-3-{1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-2-propenamide
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H25N3O2/c1-17-7-10-22(13-18(17)2)30-12-11-28-16-20(23-5-3-4-6-24(23)28)14-19(15-26)25(29)27-21-8-9-21/h3-7,10,13-14,16,21H,8-9,11-12H2,1-2H3,(H,27,29)/b19-14+
InChIKey	DJAQGTZNCBDMNL-XMHGGMMESA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_15700
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: C75077; Labnumber: SPDEM-1862; SBI_ID: SBI-015703
Synonyms	2-cyano-N-cyclopropyl-3-{1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}-2-propenamide
Temperature	318 °C