Compound Identification
SMILES
Cl.Cl.NC1=CC=C(C=C1)C(O)=O.CCOC(=O)C1CN(CCC2=CC=CC=C2)CCC1O
InChIKey
InChIKey=XXGHXSCAICUWND-UHFFFAOYSA-N
Formula
C23H32Cl2N2O5
Mass
487.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Aminobenzoic acids and derivatives
- Level 6 Aminobenzoic acids
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Level 5
Aminobenzoic acids 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
Aminobenzoic acids and derivatives
Direct Parent
Aminobenzoic acids
Alternative Parents
Piperidinecarboxylic acids Phenethylamines Benzoic acids Aniline and substituted anilines Benzoyl derivatives Aralkylamines Beta hydroxy acids and derivatives Trialkylamines Secondary alcohols Amino acids Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrochlorides Organic oxides Hydrocarbon derivatives Primary amines Carbonyl compounds
Molecular Framework
Not available
Substituents
Aminobenzoic acid - Benzoic acid - Phenethylamine - Piperidinecarboxylic acid - Benzoyl - Aniline or substituted anilines - Beta-hydroxy acid - Aralkylamine - Hydroxy acid - Piperidine - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Amino acid or derivatives - Carboxylic acid ester - Amino acid - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Primary amine - Hydrochloride - Amine - Carbonyl group - Alcohol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
External Descriptors
Not available