Compound Identification
SMILES
CCCCN1C(=O)C(CCC(=O)OCC(=O)C(\C#N)=C(/C)N)=NC2=CC=CC=C12
InChIKey
InChIKey=CJPKEIQOKFBCSK-CCEZHUSRSA-N
Formula
C21H24N4O4
Mass
396.447
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinoxalines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinoxalines
Alternative Parents
Alpha-acyloxy ketones Fatty acid esters Pyrazines Alpha-branched alpha,beta-unsaturated ketones Benzenoids Acryloyl compounds Vinylogous amides Enones Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Ketones Lactams Monocarboxylic acids and derivatives Enamines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoxaline - Fatty acid ester - Alpha-acyloxy ketone - Pyrazine - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Primary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Cyanide - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
External Descriptors
Not available