Compound Identification
SMILES
COC(=O)C1=C(O)C=C(NS(=O)(=O)C2=CC(Br)=CC=C2)C=C1
InChIKey
InChIKey=VRZIBYXKHICTGD-UHFFFAOYSA-N
Formula
C14H12BrNO5S
Mass
386.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzoic acid esters
- Level 6 o-Hydroxybenzoic acid esters
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Level 5
Benzoic acid esters
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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
Benzoic acid esters
Direct Parent
o-Hydroxybenzoic acid esters
Alternative Parents
Sulfanilides Salicylic acid and derivatives Benzenesulfonamides Benzenesulfonyl compounds Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Bromobenzenes Organosulfonamides Aryl bromides Vinylogous acids Aminosulfonyl compounds Methyl esters Organobromides Organonitrogen compounds Organic oxides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-hydroxybenzoic acid ester - Benzenesulfonamide - Salicylic acid or derivatives - Sulfanilide - Benzenesulfonyl group - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - Bromobenzene - Halobenzene - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Organosulfonic acid amide - Aryl bromide - Aryl halide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous acid - Methyl ester - Aminosulfonyl compound - Carboxylic acid ester - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.
External Descriptors
Not available