4-[(o-Chlorophenyl)azo]-1-(2,4-dinitrophenyl)-3-(p-methoxyphenyl)-5-phenylpyrazole

SpectraBase Compound ID	AAFtpqTHSSR
InChI	InChI=1S/C28H19ClN6O5/c1-40-21-14-11-18(12-15-21)26-27(31-30-23-10-6-5-9-22(23)29)28(19-7-3-2-4-8-19)33(32-26)24-16-13-20(34(36)37)17-25(24)35(38)39/h2-17H,1H3/b31-30+
InChIKey	YRFZPRHJUUPRLB-NVQSTNCTSA-N Google Search
Mol Weight	554.95 g/mol
Molecular Formula	C28H19ClN6O5
Exact Mass	554.110545 g/mol

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SpectraBase Spectrum ID	74anYxMs11
Name	4-[(o-Chlorophenyl)azo]-1-(2,4-dinitrophenyl)-3-(p-methoxyphenyl)-5-phenylpyrazole
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	554.110545431 u
Formula	C28H19ClN6O5
InChI	InChI=1S/C28H19ClN6O5/c1-40-21-14-11-18(12-15-21)26-27(31-30-23-10-6-5-9-22(23)29)28(19-7-3-2-4-8-19)33(32-26)24-16-13-20(34(36)37)17-25(24)35(38)39/h2-17H,1H3/b31-30+
InChIKey	YRFZPRHJUUPRLB-NVQSTNCTSA-N
Molecular Weight	554.950 g/mol
SMILES	N(=O)(=O)C=1C=C(C=CC1N1C(=C(C(=N1)C=1C=CC(=CC1)OC)\N=N\C=1C(=CC=CC1)Cl)C=1C=CC=CC1)N(=O)=O