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CHEBI:117147 - 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester

ChEBI IDCHEBI:117147
ChEBI Name2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester
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FormulaC22H23ClN2O6
Net Charge0
Average Mass446.887
Monoisotopic Mass446.12446
SMILESCC(C)N(C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(C)C
InChIInChI=1S/C22H23ClN2O6/c1-13(2)24(14(3)4)20(26)12-31-22(28)17-8-6-5-7-16(17)21(27)15-9-10-18(23)19(11-15)25(29)30/h5-11,13-14H,12H2,1-4H3
InChIKeySVAKXJZYTKDMNY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester (CHEBI:117147) is a benzophenones (CHEBI:22726)
Manual XrefsDatabases
LSM-28596LINCS