CHEBI:17318 - N-(3,4-dichlorophenyl)malonamate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(3,4-dichlorophenyl)malonamate
ChEBI ID CHEBI:17318
ChEBI ASCII Name N-(3,4-dichlorophenyl)malonamate
Definition A monocarboxylic acid anion that is the conjugate base of N-(3,4-dichlorophenyl)malonamic acid arising from deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12429, CHEBI:7086
Supplier Information
Download Molfile XML SDF
Formula C9H6Cl2NO3
Net Charge -1
Average Mass 247.05428
Monoisotopic Mass 245.97302
InChI InChI=1S/C9H7Cl2NO3/c10-6-2-1-5(3-7(6)11)12-8(13)4-9(14)15/h1-3H,4H2,(H,12,13)(H,14,15)/p-1
InChIKey JEFJREKVJYACNK-UHFFFAOYSA-M
SMILES [O-]C(=O)CC(=O)Nc1ccc(Cl)c(Cl)c1
ChEBI Ontology
Outgoing N-(3,4-dichlorophenyl)malonamate (CHEBI:17318) has functional parent malonamate (CHEBI:49102)
N-(3,4-dichlorophenyl)malonamate (CHEBI:17318) is a monocarboxylic acid anion (CHEBI:35757)
N-(3,4-dichlorophenyl)malonamate (CHEBI:17318) is conjugate base of N-(3,4-dichlorophenyl)malonamic acid (CHEBI:49101)
Incoming N-(3,4-dichlorophenyl)malonamic acid (CHEBI:49101) is conjugate acid of N-(3,4-dichlorophenyl)malonamate (CHEBI:17318)
IUPAC Name
3-[(3,4-dichlorophenyl)amino]-3-oxopropanoate
Synonyms Sources
N-(3,4-Dichlorophenyl)-malonamate KEGG COMPOUND
N-(3,4-dichlorophenyl)malonamate UniProt
Manual Xref Database
C04205 KEGG COMPOUND
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Last Modified
13 November 2017