SpectraBase Spectrum ID |
KMiM2gUO1kC |
Name |
Benzoic acid, 3-[2-(3-cyano-2,5-dihydro-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-methyl- |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H13N5O3 |
InChI |
InChI=1S/C18H13N5O3/c1-11-7-8-12(18(25)26)9-14(11)20-21-16-15(10-19)22-23(17(16)24)13-5-3-2-4-6-13/h2-9,22H,1H3,(H,25,26)/b21-20+ |
InChIKey |
WJGFEAXUYVDNPX-QZQOTICOSA-N |
Molecular Weight |
347.334 g/mol |
SMILES |
N1N(C(C(\N=N\c2c(ccc(C(O)=O)c2)C)=C1C#N)=O)c1ccccc1 |
SPLASH |
splash10-004i-9301000000-8212cb6e105fc1395098 |
Source of Spectrum |
JX-2015-3-992 |
Synonyms |
(E)-3-((5-cyano-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl)-4-methylbenzoic acid |
Wiley ID |
1724516 |