Compound Identification
SMILES
OC(=O)C1=C(NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C=CC(Br)=C1
InChIKey
InChIKey=QNKIXWVIBIGIBY-UHFFFAOYSA-N
Formula
C14H9BrF3NO4S
Mass
424.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Sulfanilides
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Sulfanilides
Intermediate Tree Nodes
Not available
Direct Parent
Sulfanilides
Alternative Parents
3-halobenzoic acids Trifluoromethylbenzenes Benzenesulfonamides Halobenzoic acids Benzenesulfonyl compounds Benzoic acids Benzoyl derivatives Bromobenzenes Organosulfonamides Aryl bromides Vinylogous amides Aminosulfonyl compounds Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Organooxygen compounds Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonamide - Trifluoromethylbenzene - Sulfanilide - 3-halobenzoic acid or derivatives - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Benzenesulfonyl group - Benzoyl - Bromobenzene - Halobenzene - Organosulfonic acid amide - Aryl bromide - Aryl halide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Aminosulfonyl compound - Sulfonyl - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Alkyl halide - Organohalogen compound - Organobromide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as sulfanilides. These are organic aromatic compounds containing a sulfanilide moiety, with the general structure RS(=O)(=O)NC1=CC=CC=C1.
External Descriptors
Not available