CHEBI:121744 - 2,6-dimethoxybenzoic acid [[amino(pyridin-4-yl)methylidene]amino] ester

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ChEBI Name 2,6-dimethoxybenzoic acid [[amino(pyridin-4-yl)methylidene]amino] ester
ChEBI ID CHEBI:121744
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H15N3O4
Net Charge 0
Average Mass 301.298
Monoisotopic Mass 301.10626
InChI InChI=1S/C15H15N3O4/c1-20-11-4-3-5-12(21-2)13(11)15(19)22-18-14(16)10-6-8-17-9-7-10/h3-9H,1-2H3,(H2,16,18)
InChIKey OZEFPPKPFJGKSL-UHFFFAOYSA-N
SMILES COC1=C(C(=CC=C1)OC)C(=O)ON=C(C2=CC=NC=C2)N
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2,6-dimethoxybenzoic acid [[amino(pyridin-4-yl)methylidene]amino] ester (CHEBI:121744) is a methoxybenzoic acid (CHEBI:25238)
Manual Xref Database
LSM-33186 LINCS
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