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CHEBI:114757 - 4-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid propan-2-yl ester

ChEBI IDCHEBI:114757
ChEBI Name4-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid propan-2-yl ester
Stars
Last Modified9 March 2018
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FormulaC16H18BrN3O3
Net Charge0
Average Mass380.242
Monoisotopic Mass379.05315
SMILESCCn1ncc(Br)c1C(=O)Nc1ccc(C(=O)OC(C)C)cc1
InChIInChI=1S/C16H18BrN3O3/c1-4-20-14(13(17)9-18-20)15(21)19-12-7-5-11(6-8-12)16(22)23-10(2)3/h5-10H,4H2,1-3H3,(H,19,21)
InChIKeyPQCYGOOWNHMIIA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid propan-2-yl ester (CHEBI:114757) is a aromatic amide (CHEBI:62733)
4-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid propan-2-yl ester (CHEBI:114757) is a isopropyl ester (CHEBI:35725)
4-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid propan-2-yl ester (CHEBI:114757) is a secondary carboxamide (CHEBI:140325)
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