CHEBI:107238 - 3-acetamidobenzoic acid [2-(2-chlorophenyl)-2-oxoethyl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-acetamidobenzoic acid [2-(2-chlorophenyl)-2-oxoethyl] ester
ChEBI ID CHEBI:107238
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H14ClNO4
Net Charge 0
Average Mass 331.751
Monoisotopic Mass 331.06114
InChI InChI=1S/C17H14ClNO4/c1-11(20)19-13-6-4-5-12(9-13)17(22)23-10-16(21)14-7-2-3-8-15(14)18/h2-9H,10H2,1H3,(H,19,20)
InChIKey BXBOJSOQMGHPHX-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=CC=C2Cl
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-acetamidobenzoic acid [2-(2-chlorophenyl)-2-oxoethyl] ester (CHEBI:107238) is a amidobenzoic acid (CHEBI:48470)
Manual Xref Database
LSM-18592 LINCS
View more database links