| SpectraBase Spectrum ID |
5g4njgJdyyT |
| Name |
(E)-2-(Benzoylamino)-3-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)propenoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21N3O3 |
| InChI |
InChI=1S/C22H21N3O3/c1-15-19(16(2)25(24-15)14-17-9-5-3-6-10-17)13-20(22(27)28)23-21(26)18-11-7-4-8-12-18/h3-13H,14H2,1-2H3,(H,23,26)(H,27,28)/b20-13+ |
| InChIKey |
ODMDOVHGSRCEDJ-DEDYPNTBSA-N |
| Molecular Weight |
375.428 g/mol |
| SMILES |
N(\C(C(=O)O)=C\c1c([n](Cc2ccccc2)nc1C)C)C(=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0902000000-9d961f9881dfa2c3ba47 |
| Source of Spectrum |
F-55-275-4 |
| Synonyms |
(2E)-2-(benzoylamino)-3-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-propenoic acid |
| Wiley ID |
836468 |
