Compound Identification
SMILES
COC(=O)C1=CC(N=[N+]=[N-])=C(C=C1)C(=O)OC
InChIKey
InChIKey=PMEDBKGAHOFNES-UHFFFAOYSA-N
Formula
C10H9N3O4
Mass
235.199
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Phthalic acid and derivatives
-
Level 6
Phthalate esters
- Level 7 p-Phthalate esters
-
Level 6
Phthalate esters
-
Level 5
Phthalic acid and derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Phthalic acid and derivatives - Phthalate esters
Direct Parent
p-Phthalate esters
Alternative Parents
P-phthalic acid and derivatives 2-azidobenzoic acids Benzoic acid esters Phenylazides Benzoyl derivatives Methyl esters Azo imides Azo compounds Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Para-phthalic acid ester - 2-azidobenzoic acid - Para_phthalic_acid - Benzoate ester - Benzoyl - Phenylazide - Methyl ester - Azo compound - Azo imide - Carboxylic acid ester - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-phthalate esters. These are ester derivatives of p-phthalic acids, which are based on a benzene 1,4-dicarboxylic acid skeleton.
External Descriptors
Not available