Compound Identification
SMILES
CC1=C(C(O)=O)C(NC2=CC=CC=C2)=C(NC2=CC=CC=C2)C(C(O)=O)=C1C
InChIKey
InChIKey=OERSSJHLKKAUHT-UHFFFAOYSA-N
Formula
C22H20N2O4
Mass
376.412
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 P-phthalic acid and derivatives
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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
Direct Parent
P-phthalic acid and derivatives
Alternative Parents
Aminobenzoic acids Benzoic acids o-Xylenes O-phenylenediamines Benzoyl derivatives Primary aromatic amines Vinylogous amides Amino acids Secondary amines Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Para_phthalic_acid - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid - O-phenylenediamine - Phenylenediamine - Benzoyl - Aniline or substituted anilines - Xylene - O-xylene - Primary aromatic amine - Vinylogous amide - Amino acid - Amino acid or derivatives - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-phthalic acid and derivatives. These are compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 4.
External Descriptors
Not available