Metolachlor CGA 357704 (CHEBI:182739)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Metolachlor CGA 357704

ChEBI ID	CHEBI:182739

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H17NO5

Net Charge

Average Mass

279.292

Monoisotopic Mass

279.11067

InChI

InChI=1S/C14H17NO5/c1-4-10-7-5-6-8(2)11(10)15(9(3)13(17)18)12(16)14(19)20/h5-7,9H,4H2,1-3H3,(H,17,18)(H,19,20)

InChIKey

IMFSUYMDPTXKCC-UHFFFAOYSA-N

SMILES

OC(=O)C(N(C=1C(CC)=CC=CC1C)C(=O)C(O)=O)C

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Metolachlor CGA 357704 (CHEBI:182739) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name

2-(2-ethyl-6-methyl-N-oxaloanilino)propanoic acid