Compound Identification
SMILES
OC(=O)C1=C(O)C=C(NC=C(C=O)C2=NC3=CC=CC=C3O2)C=C1
InChIKey
InChIKey=XVYUVGUFSQEXAT-UHFFFAOYSA-N
Formula
C17H12N2O5
Mass
324.292
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
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Level 6
Salicylic acid and derivatives
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Level 7
Aminosalicylic acids and derivatives
- Level 8 Aminosalicylic acids
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Level 7
Aminosalicylic acids and derivatives
-
Level 6
Salicylic acid and derivatives
-
Level 5
Hydroxybenzoic acid 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
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives - Aminosalicylic acids and derivatives
Direct Parent
Aminosalicylic acids
Alternative Parents
4-aminosalicylic acids Salicylic acids Aminobenzoic acids Benzoic acids Benzoxazoles m-Aminophenols Aniline and substituted anilines Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Vinylogous amides Vinylogous acids Oxazoles Heteroaromatic compounds Enals Azacyclic compounds Enamines Carboxylic acids Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-aminosalicylic acid - Aminosalicylic acid - Salicylic acid - Aminobenzoic acid or derivatives - Aminobenzoic acid - Benzoxazole - Benzoic acid - Benzoyl - M-aminophenol - Aniline or substituted anilines - Aminophenol - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Azole - Vinylogous amide - Vinylogous acid - Oxazole - Enal - Alpha,beta-unsaturated aldehyde - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Enamine - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Aldehyde - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aminosalicylic acids. These are salicylic acids carrying an amino group on the benzene ring.
External Descriptors
Not available