Compound Identification
SMILES
[O-][N+](=O)C1=CC(Cl)=C(NC(=O)COC(=O)C2=NC=CN=C2)C=C1
InChIKey
InChIKey=ZLQOFLHZEMKZHC-UHFFFAOYSA-N
Formula
C13H9ClN4O5
Mass
336.69
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
-
Subclass
Pyrazines
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Level 5
Pyrazine carboxylic acids and derivatives
- Level 6 Pyrazine carboxylic acids
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Level 5
Pyrazine carboxylic acids and derivatives
-
Subclass
Pyrazines
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Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrazines
Intermediate Tree Nodes
Pyrazine carboxylic acids and derivatives
Direct Parent
Pyrazine carboxylic acids
Alternative Parents
Anilides Nitrobenzenes N-arylamides Nitroaromatic compounds Chlorobenzenes Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Pyrazine carboxylic acid - Anilide - Nitroaromatic compound - N-arylamide - Chlorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organic oxoazanium - Organic nitrogen compound - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic zwitterion - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazine carboxylic acids. These are heterocyclic compounds containing a pyrazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available