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methyl 3-({[4-(3,4-dichlorophenyl)-1-piperazinyl]acetyl}amino)-1H-indole-2-carboxylate
SpectraBase Compound ID 2hEhM5Wog6h
InChI InChI=1S/C22H22Cl2N4O3/c1-31-22(30)21-20(15-4-2-3-5-18(15)25-21)26-19(29)13-27-8-10-28(11-9-27)14-6-7-16(23)17(24)12-14/h2-7,12,25H,8-11,13H2,1H3,(H,26,29)
InChIKey CPBIIWOFEZGPSR-UHFFFAOYSA-N
Mol Weight 461.35 g/mol
Molecular Formula C22H22Cl2N4O3
Exact Mass 460.106896 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6EHHEFGGXia
Name methyl 3-({[4-(3,4-dichlorophenyl)-1-piperazinyl]acetyl}amino)-1H-indole-2-carboxylate
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/C22H22Cl2N4O3/c1-31-22(30)21-20(15-4-2-3-5-18(15)25-21)26-19(29)13-27-8-10-28(11-9-27)14-6-7-16(23)17(24)12-14/h2-7,12,25H,8-11,13H2,1H3,(H,26,29)
InChIKey CPBIIWOFEZGPSR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11807
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: D64056; Labnumber: SIMAK-01760; SBI_ID: SBI-011810
Temperature 318 °C