Compound Identification
SMILES
OC(=O)C1=CC(NC(NC2=CC=CC(=C2)C(O)=O)C(Cl)(Cl)Cl)=CC=C1
InChIKey
InChIKey=IGZXUBTWKLORRQ-UHFFFAOYSA-N
Formula
C16H13Cl3N2O4
Mass
403.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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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
Phenylalkylamines Benzoyl derivatives Secondary alkylarylamines Dicarboxylic acids and derivatives Amino acids Carboxylic acids Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoic acid - Benzoyl - Phenylalkylamine - Secondary aliphatic/aromatic amine - Dicarboxylic acid or derivatives - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Alkyl chloride - Organic nitrogen compound - Organic oxide - Amine - Organopnictogen compound - Aromatic homomonocyclic 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