SpectraBase Spectrum ID |
5QA7Rcojfe2 |
Name |
1H-[1,2,4]Triazolo[1,2-a]pyridazine-1,3(2H)-dione, 5-(benzoyloxy)-8-[(benzoyloxy)methyl]-5,8-dihydro-2-phenyl- |
CAS Registry Number |
114133-00-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H21N3O6 |
InChI |
InChI=1S/C27H21N3O6/c31-24(19-10-4-1-5-11-19)35-18-22-16-17-23(36-25(32)20-12-6-2-7-13-20)30-27(34)28(26(33)29(22)30)21-14-8-3-9-15-21/h1-17,22-23H,18H2 |
InChIKey |
DLZIMXNSQFNIBT-UHFFFAOYSA-N |
Molecular Weight |
483.480 g/mol |
SMILES |
C1(N2N(C(N1c1ccccc1)=O)C(COC(=O)c1ccccc1)C=CC2OC(=O)c1ccccc1)=O |
SPLASH |
splash10-0a4i-0901000000-00e06d486f4df19346e0 |
Source of Spectrum |
J-53-1870-34 |
Synonyms |
2-Phenyl-5-(benzoyloxy)-8-[(benzoyloxy)methyl]-4,5,8,9-tetrahydro-2H-triazolo[1,2-a]pyridazine-1,3-dione
8-[(benzoyloxy)methyl]-1,3-dioxo-2-phenyl-2,3,5,8-tetrahydro-1H-[1,2,4]triazolo[1,2-a]pyridazin-5-yl benzoate |
Wiley ID |
1395834 |