SpectraBase Spectrum ID |
8e5ecB9nPtY |
Name |
3-(4-{[5-(4-bromophenyl)-2-furyl]methylene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H15BrN2O4 |
InChI |
InChI=1S/C22H15BrN2O4/c1-13-19(12-18-9-10-20(29-18)14-5-7-16(23)8-6-14)21(26)25(24-13)17-4-2-3-15(11-17)22(27)28/h2-12H,1H3,(H,27,28)/b19-12+ |
InChIKey |
JFPHNRQUQCPKSL-XDHOZWIPSA-N |
Molecular Weight |
451.276 g/mol |
SMILES |
OC(c1cc(N2C(\C(C(=N2)C)=C\c2oc(-c3ccc(cc3)Br)cc2)=O)ccc1)=O |
SPLASH |
splash10-0udi-1430900000-935c96b83f2878749757 |
Synonyms |
3-((4E)-4-{[5-(4-bromophenyl)-2-furyl]methylene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
3-[4-[5-(4-bromo-phenyl)-furan-2-ylmethylene]-3-methyl-5-oxo-4,5-dihydro-pyrazol-1-yl]-benzoic acid |
Wiley ID |
1454868 |