SpectraBase Spectrum ID |
56jFrc0t6gw |
Name |
Tert-butyl 2-{1-[3-(4-cyanophenyl)-5-hydroxy-1-phenyl-1H-pyrazol-4-yl]ethylidene}hydrazinecarboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
417.180089618 u |
Formula |
C23H23N5O3 |
InChI |
InChI=1S/C23H23N5O3/c1-15(25-26-22(30)31-23(2,3)4)19-20(17-12-10-16(14-24)11-13-17)27-28(21(19)29)18-8-6-5-7-9-18/h5-13,29H,1-4H3,(H,26,30) |
InChIKey |
WETCWTUFXZKMKP-UHFFFAOYSA-N |
Molecular Weight |
417.469 g/mol |
SMILES |
C(N\N=C\(C1=C(O)N(C2=CC=CC=C2)N=C1C1=CC=C(C#N)C=C1)C)(OC(C)(C)C)=O |