EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:121513 - 4-methoxy-3-nitrobenzoic acid (2-anilino-2-oxoethyl) ester

ChEBI IDCHEBI:121513
ChEBI Name4-methoxy-3-nitrobenzoic acid (2-anilino-2-oxoethyl) ester
Stars
DownloadsMolfile
FormulaC16H14N2O6
Net Charge0
Average Mass330.296
Monoisotopic Mass330.08519
SMILESCOc1ccc(C(=O)OCC(=O)Nc2ccccc2)cc1[N+](=O)[O-]
InChIInChI=1S/C16H14N2O6/c1-23-14-8-7-11(9-13(14)18(21)22)16(20)24-10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19)
InChIKeyACKHFLCJMXQPFM-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-methoxy-3-nitrobenzoic acid (2-anilino-2-oxoethyl) ester (CHEBI:121513) is a nitrobenzoic acid (CHEBI:25553)
Manual XrefsDatabases
LSM-32956LINCS