Compound Identification
SMILES
C1CN=C(N1)C1=CC=CC=C1.OC(=O)C1=CC(=CC(=C1)C(O)=O)C(O)=O
InChIKey
InChIKey=GFTQTSPNASGPJZ-UHFFFAOYSA-N
Formula
C18H16N2O6
Mass
356.334
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
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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
Not available
Direct Parent
Benzoic acids
Alternative Parents
Benzoyl derivatives Imidolactams Imidazolines Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Not available
Substituents
Benzoic acid - Benzoyl - Imidolactam - 2-imidazoline - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available