Ethyl 2-cyano-3-[(6-methoxy-8-quinolyl)amino]acrylate (CHEBI:167788)

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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	Ethyl 2-cyano-3-[(6-methoxy-8-quinolyl)amino]acrylate

ChEBI ID	CHEBI:167788

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H15N3O3

Net Charge

Average Mass

297.314

Monoisotopic Mass

297.11134

InChI

InChI=1S/C16H15N3O3/c1-3-22-16(20)12(9-17)10-19-14-8-13(21-2)7-11-5-4-6-18-15(11)14/h4-8,10,19H,3H2,1-2H3

InChIKey

SPIFGNJOLVTQLH-UHFFFAOYSA-N

SMILES

O(C=1C=C2C(N=CC=C2)=C(NC=C(C(OCC)=O)C#N)C1)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood serum (BTO:0000133). See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

ChEBI Ontology
Outgoing	Ethyl 2-cyano-3-[(6-methoxy-8-quinolyl)amino]acrylate (CHEBI:167788) is a aminoquinoline (CHEBI:36709)

IUPAC Name

ethyl 2-cyano-3-[(6-methoxyquinolin-8-yl)amino]prop-2-enoate