Compound Identification
SMILES
COC(=O)C1=C(C=CC(Br)=C1)S(=O)(=O)NNC(=O)C1CC1
InChIKey
InChIKey=KMCOINLUZPJGIM-UHFFFAOYSA-N
Formula
C12H13BrN2O5S
Mass
377.21
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- 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
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Benzenesulfonamides 3-halobenzoic acids and derivatives Benzenesulfonyl compounds Benzoyl derivatives Bromobenzenes Sulfonohydrazides Hydrazinosulfonyl compounds Cyclopropanecarboxylic acids and derivatives Aryl bromides Methyl esters Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonamide - Benzoate ester - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Hydrazinosulfonyl compound - Cyclopropanecarboxylic acid or derivatives - Sulfonohydrazide - Methyl ester - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available