| SpectraBase Spectrum ID |
AbIhvUQk6h5 |
| Name |
4-{3-[(1E)-3-(4-chloroanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoic acid |
| 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/C24H20ClN3O3/c1-14-10-17(24(30)31)4-9-22(14)28-15(2)11-18(16(28)3)12-19(13-26)23(29)27-21-7-5-20(25)6-8-21/h4-12H,1-3H3,(H,27,29)(H,30,31)/b19-12+ |
| InChIKey |
ZQVVUHUEPBSDCY-XDHOZWIPSA-N |
| NMR Offset |
17.5285 |
| NMR Spectrometer Frequency |
500.138 |
| Observed nucleus |
1H |
| Origin |
1H_UZI_26187_2778 |
| 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: UZI/1011218; Labnumber: ARF3733; UZI_ID: UZI-002780 |
| Synonyms |
4-{3-[3-(4-chloroanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoic acid |
| Temperature |
300 °C |
![4-{3-[(1E)-3-(4-chloroanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoic acid](/api/spectrum/AbIhvUQk6h5/structure.png?h=300&w=458 "4-{3-[(1E)-3-(4-chloroanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoic acid")
