| SpectraBase Spectrum ID |
FT1FbBAgW7H |
| Name |
2-Chloro-5-[3-methyl-5-oxo-4-(1H-pyrrol-2-ylmethylene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H12ClN3O3 |
| InChI |
InChI=1S/C16H12ClN3O3/c1-9-12(7-10-3-2-6-18-10)15(21)20(19-9)11-4-5-14(17)13(8-11)16(22)23/h2-8,18H,1H3,(H,22,23)/b12-7+ |
| InChIKey |
QETSFVXNMVHIFU-KPKJPENVSA-N |
| Molecular Weight |
329.743 g/mol |
| SMILES |
[nH]1cccc1\C=C\1C(N(c2cc(C(=O)O)c(cc2)Cl)N=C1C)=O |
| SPLASH |
splash10-016r-9804000000-bc53220847b094dba864 |
| Synonyms |
2-Chloro-5-[(4E)-3-methyl-5-oxo-4-(1H-pyrrol-2-ylmethylene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
2-Chloro-5-[3-methyl-5-oxo-4-(1H-pyrrol-2-ylmethylene)-4,5-dihydro-pyrazol-1-yl]-benzoic acid |
| Wiley ID |
1453201 |
![2-Chloro-5-[3-methyl-5-oxo-4-(1H-pyrrol-2-ylmethylene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid](/api/spectrum/FT1FbBAgW7H/structure.png?h=300&w=458 "2-Chloro-5-[3-methyl-5-oxo-4-(1H-pyrrol-2-ylmethylene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid")
