| SpectraBase Spectrum ID |
8VzZXy71kIm |
| Name |
(E)-2-(Benzoylamino)-3-[1-benzyl-3-methyl-5-phenyl-1H-pyrazol-4-yl]propenoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
437.173941610 u |
| Formula |
C27H23N3O3 |
| InChI |
InChI=1S/C27H23N3O3/c1-19-23(17-24(27(32)33)28-26(31)22-15-9-4-10-16-22)25(21-13-7-3-8-14-21)30(29-19)18-20-11-5-2-6-12-20/h2-17H,18H2,1H3,(H,28,31)(H,32,33)/b24-17+ |
| InChIKey |
HBSBEUNQLYJZLI-JJIBRWJFSA-N |
| Molecular Weight |
437.499 g/mol |
| SMILES |
C1(=C(N(CC=2C=CC=CC2)N=C1C)C1=CC=CC=C1)\C=C/(NC(=O)C1=CC=CC=C1)C(=O)O |
![(E)-2-(Benzoylamino)-3-[1-benzyl-3-methyl-5-phenyl-1H-pyrazol-4-yl]propenoic acid](/api/spectrum/8VzZXy71kIm/structure.png?h=300&w=458 "(E)-2-(Benzoylamino)-3-[1-benzyl-3-methyl-5-phenyl-1H-pyrazol-4-yl]propenoic acid")
