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methyl 3-({[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]acetyl}amino)-4-chloro-1H-indole-2-carboxylate
SpectraBase Compound ID 8b8NQX2q01e
InChI InChI=1S/C24H25ClN4O5/c1-32-24(31)23-22(21-16(25)3-2-4-17(21)26-23)27-20(30)13-29-9-7-28(8-10-29)12-15-5-6-18-19(11-15)34-14-33-18/h2-6,11,26H,7-10,12-14H2,1H3,(H,27,30)
InChIKey SRHFYZRWOAPQNN-UHFFFAOYSA-N
Mol Weight 484.94 g/mol
Molecular Formula C24H25ClN4O5
Exact Mass 484.151348 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 786s2iWUoCu
Name methyl 3-({[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]acetyl}amino)-4-chloro-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/C24H25ClN4O5/c1-32-24(31)23-22(21-16(25)3-2-4-17(21)26-23)27-20(30)13-29-9-7-28(8-10-29)12-15-5-6-18-19(11-15)34-14-33-18/h2-6,11,26H,7-10,12-14H2,1H3,(H,27,30)
InChIKey SRHFYZRWOAPQNN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24924
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: D48937; Labnumber: SIMAK-01630; SBI_ID: SBI-024928
Temperature 308 °C