CHEBI:105883 - 2-phenylbutanoic acid [2-(3,5-dichloroanilino)-2-oxoethyl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-phenylbutanoic acid [2-(3,5-dichloroanilino)-2-oxoethyl] ester
ChEBI ID CHEBI:105883
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H17Cl2NO3
Net Charge 0
Average Mass 366.239
Monoisotopic Mass 365.05855
InChI InChI=1S/C18H17Cl2NO3/c1-2-16(12-6-4-3-5-7-12)18(23)24-11-17(22)21-15-9-13(19)8-14(20)10-15/h3-10,16H,2,11H2,1H3,(H,21,22)
InChIKey FQHGDQCBAQOOEQ-UHFFFAOYSA-N
SMILES CCC(C1=CC=CC=C1)C(=O)OCC(=O)NC2=CC(=CC(=C2)Cl)Cl
ChEBI Ontology
Outgoing 2-phenylbutanoic acid [2-(3,5-dichloroanilino)-2-oxoethyl] ester (CHEBI:105883) is a anilide (CHEBI:13248)
Manual Xref Database
LSM-17244 LINCS
View more database links