| SpectraBase Spectrum ID |
6Ts2QMTnFbV |
| Name |
(E)-2-benzamido-3-[3-methyl-5-phenyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]-2-propenoic acid |
| Alternate Name(s) |
(E)-2-benzamido-3-[3-methyl-5-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acrylic acid
(E)-2-benzamido-3-[3-methyl-5-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]prop-2-enoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20F3N3O3 |
| InChI |
InChI=1S/C27H20F3N3O3/c1-17-22(16-23(26(35)36)31-25(34)19-11-6-3-7-12-19)24(18-9-4-2-5-10-18)33(32-17)21-14-8-13-20(15-21)27(28,29)30/h2-16H,1H3,(H,31,34)(H,35,36)/b23-16+ |
| InChIKey |
CJHRCJPGASPBLM-XQNSMLJCSA-N |
| Molecular Weight |
491.470 g/mol |
| SMILES |
N(\C(C(=O)O)=C\c1c(n[n](c1-c1ccccc1)-c1cc(ccc1)C(F)(F)F)C)C(c1ccccc1)=O |
| SPLASH |
splash10-0a4i-0900300000-1163e84690f40c063d0d |
| Source of Spectrum |
K-2002-679-5 |
| Wiley ID |
1580948 |
![(E)-2-benzamido-3-[3-methyl-5-phenyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]-2-propenoic acid](/api/spectrum/6Ts2QMTnFbV/structure.png?h=300&w=458 "(E)-2-benzamido-3-[3-methyl-5-phenyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]-2-propenoic acid")
