Metazachlor BH479-12 (CHEBI:182564)

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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	Metazachlor BH479-12

ChEBI ID	CHEBI:182564

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H13N3O5

Net Charge

Average Mass

303.274

Monoisotopic Mass

303.08552

InChI

InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)

InChIKey

DFJUHFNLKWOTIZ-UHFFFAOYSA-N

SMILES

O=C(N(C1=C(C=CC=C1C(O)=O)C)CN2N=CC=C2)C(O)=O

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	Metazachlor BH479-12 (CHEBI:182564) is a amidobenzoic acid (CHEBI:48470)

IUPAC Name

3-methyl-2-[oxalo(pyrazol-1-ylmethyl)amino]benzoic acid