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CHEBI:120736 - benzoic acid [2-methoxy-5-[[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester

Default Structure
ChEBI IDCHEBI:120736
ChEBI Namebenzoic acid [2-methoxy-5-[[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester
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DownloadsMolfile
FormulaC22H17N3O6
Net Charge0
Average Mass419.393
Monoisotopic Mass419.11174
SMILESCOc1ccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(=O)c1ccccc1
InChIInChI=1S/C22H17N3O6/c1-30-19-11-10-15(12-20(19)31-22(27)16-6-3-2-4-7-16)14-23-24-21(26)17-8-5-9-18(13-17)25(28)29/h2-14H,1H3,(H,24,26)
InChIKeyLOPVZRLCZIXWIQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
benzoic acid [2-methoxy-5-[[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester (CHEBI:120736) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
LSM-32178LINCS